Basic information
- Standard SMILES
Nc1ccc2ncnc(Nc3cccc(Br)c3)c2n1- InChIKey
PWLAEHXFQCNKSK-UHFFFAOYSA-N- Molecular formula
- C13H10BrN5
- Average molar mass
- 316.16 g/mol
Names & identifiers
- Preferred name
- 4-N-(3-bromophenyl)pyrido[3,2-d]pyrimidine-4,6-diamine
- IUPAC
- 4-N-(3-bromophenyl)pyrido[3,2-d]pyrimidine-4,6-diamine
Names & synonyms
CHEMBL300217Pyrido[3,2-d]pyrimidine 11bpyrido[3,2-d]pyrimidine-4,6-diamine,n4-(3-bromophenyl)-171178-57-7BDBM3617SCHEMBL2982644PWLAEHXFQCNKSK-UHFFFAOYSA-4-N-(3-bromophenyl)pyrido[3,2-d]pyrimidine-4,6-diaminePWLAEHXFQCNKSK-UHFFFAOYSA-N6-amino-4-(3-bromoanilino)pyrido[3,2-d]pyrimidine6-amino-4-[(3-bromo-phenyl)amino]pyrido[3,2-d]pyrimidine6-amino-4-[(3-bromophenyl)amino]-pyrido[3,2-d]pyrimidine
Show more names
6-amino-4-[(3-bromophenyl)amino]pyrido[3,2-d]pyrimidineInChI=1/C13H10BrN5/c14-8-2-1-3-9(6-8)18-13-12-10(16-7-17-13)4-5-11(15)19-12/h1-7H,(H2,15,19)(H,16,17,18)
Database identifiers
- PubChem CID
- 5328274
- ChEMBL
CHEMBL300217
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 303
Related reactions
10 records
Compound notes
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