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Identification
Molecular formula
C14H12BrN5
CAS number
10147-28-5
IUPAC name
N4-(3-bromophenyl)-N6-methyl-pyrido[3,4-d]pyrimidine-4,6-diamine
State
State
The compound is typically a solid at room temperature.
Melting point (Celsius)
225.00
Melting point (Kelvin)
498.15
Boiling point (Celsius)
540.00
Boiling point (Kelvin)
813.15
General information
Molecular weight
357.19g/mol
Molar mass
357.2100g/mol
Density
1.5600g/cm3
Appearence

N4-(3-bromophenyl)-N6-methyl-pyrido[3,4-d]pyrimidine-4,6-diamine typically appears as a crystalline solid with a pale yellow to tan color. The precise appearance can vary depending on factors such as purity and crystal size.

Comment on solubility

Solubility Characteristics of N4-(3-bromophenyl)-N6-methyl-pyrido[3,4-d]pyrimidine-4,6-diamine

The compound N4-(3-bromophenyl)-N6-methyl-pyrido[3,4-d]pyrimidine-4,6-diamine, with the formula C14H12BrN5, exhibits distinctive solubility properties influenced by its chemical structure. Generally, the solubility of a compound can be dependent on several factors such as:

  • Molecular Structure: The presence of bromine substituents can affect solubility in organic solvents.
  • Polarity: The overall polarity of the molecule will determine its affinity for water versus organic solvents.
  • Hydrogen Bonding: Functional groups capable of hydrogen bonding can enhance solubility in polar solvents.

In the case of this specific compound:

  • Solubility in Water: It is likely to be limited due to the hydrophobic characteristics introduced by the bromophenyl and pyrimidine rings.
  • Solubility in Organic Solvents: It may exhibit better solubility in organic solvents such as DMSO, DMF, or acetone.

As with many **heterocyclic compounds**, their solubility can vary significantly based on conditions such as temperature, pH, and the presence of other solutes. Therefore, empirical testing is suggested to accurately determine the solubility behavior of this compound under specific laboratory conditions.

Interesting facts

Interesting Facts About N4-(3-bromophenyl)-N6-methyl-pyrido[3,4-d]pyrimidine-4,6-diamine

N4-(3-bromophenyl)-N6-methyl-pyrido[3,4-d]pyrimidine-4,6-diamine is a fascinating compound with a diverse range of applications in the field of medicinal chemistry and material science. Here are some engaging insights into this unique molecule:

  • Anticancer Potential: This compound belongs to a class of molecules that are being studied for their potential anticancer properties. Its structural features suggest that it may interact with biological targets involved in cell division and tumor growth.
  • Novel Structure: Featuring a pyrido[3,4-d]pyrimidine skeleton, the compound is notable for its intricate arrangement of nitrogen-containing rings. This complex structure contributes to its unique chemical reactivity and biological properties.
  • Halogen Influence: The presence of the bromine atom in the aromatic phenyl group significantly alters the compound's electronic properties, which can impact its binding affinity to various targets in biochemical systems.
  • Research Applications: Scientists are exploring derivatives of this compound in drug design, specifically aimed at enhancing therapeutic efficacy and reducing side effects in cancer treatment.
  • Mechanistic Studies: Investigations into how this compound interacts with cellular mechanisms can yield insights into cancer biology and pave the way for the development of more effective agents.

In conclusion, the study of N4-(3-bromophenyl)-N6-methyl-pyrido[3,4-d]pyrimidine-4,6-diamine opens up exciting avenues in both theoretical research and practical applications. As researchers continue to unravel its properties, this compound may well contribute significantly to advancements in medicinal chemistry.

Synonyms
171179-06-9
PD158780
pd 158780
N4-(3-bromophenyl)-N6-methylpyrido[3,4-d]pyrimidine-4,6-diamine
PD-158780
4-N-(3-bromophenyl)-6-N-methylpyrido[3,4-d]pyrimidine-4,6-diamine
AC1L1IRV
N4-(3-Bromophenyl)-N6-methyl-pyrido[3,4-d]pyrimidine-4,6-diamine
CHEMBL53753
CHEBI:92843
DTXSID20274443
4-(3-bromoanilino)-6-methylaminopyrido[3,4-d]pyrimidine
4-[(3-bromophenyl)amino]-6-(methylamino)pyrido[3,4-d]pyrimidine
4-(3-bromoanilino)-6-(methylamino)pyrido[3,4-d]pyrimidine
N4-((3-bromophenyl)amino)-6-(methylamino)pyrido(3,4-d)pyrimidine
N4-(3-Bromophenyl)-N6-methylpyrido(3,4-d)pyrimidine-4,6-diamine
N(4)-(3-bromophenyl)-N(6)-methylpyrido[3,4-d]pyrimidine-4,6-diamine
4-(3-bromoanilino)-6-(methylamino)pyrido(3,4-d)pyrimidine
4-(3-bromoanilino)-6-methylaminopyrido(3,4-d)pyrimidine
C14H12BrN5
4-((3-bromophenyl)amino)-6-(methylamino)pyrido(3,4-d)pyrimidine
N(4)-(3-bromophenyl)-N(6)-methylpyrido(3,4-d)pyrimidine-4,6-diamine
KFHMLBXBRCITHF-UHFFFAOYSA-N
MFCD00942160
4-[(3-Bromophenyl)amino]-6-(methylamino)-pyrido[3,4-d]pyridimine
Pyrido[3,4-d]pyrimidine-4,6-diamine, N4-(3-bromophenyl)-N6-methyl-
BDBM3603
GTPL6015
SCHEMBL1262166
KFHMLBXBRCITHF-UHFFFAOYSA-
DTXCID90225922
HMS3229I03
HMS3269F15
HMS3677L03
BCP07290
AKOS024457199
CCG-206769
CS-3483
FB76801
SDCCGSBI-0086689.P003
NCGC00167795-01
NCGC00167795-06
AS-55979
HY-18609
PD158780?
P2567
C73291
PD158780, >=98% (HPLC)
BRD-K48735772-001-01-4
BRD-K48735772-001-03-0
Q27088268
PD 158780 - CAS 171179-06-9
683-576-1
InChI=1/C14H12BrN5/c1-16-13-6-11-12(7-17-13)18-8-19-14(11)20-10-4-2-3-9(15)5-10/h2-8H,1H3,(H,16,17)(H,18,19,20)