Basic information
- Standard SMILES
COc1ccc2ncnc(Nc3cccc(Br)c3)c2n1- InChIKey
ZXEVFSPNUIEQJL-UHFFFAOYSA-N- Molecular formula
- C14H11BrN4O
- Average molar mass
- 331.17 g/mol
Names & identifiers
- Preferred name
- N-(3-bromophenyl)-6-methoxypyrido[3,2-d]pyrimidin-4-amine
- IUPAC
- N-(3-bromophenyl)-6-methoxypyrido[3,2-d]pyrimidin-4-amine
Names & synonyms
CHEMBL50519Pyrido[3,2-d]pyrimidine 11hpyrido[3,2-d]pyrimidin-4-amine,n-(3-bromophenyl)-6-methoxy-171178-60-2BDBM3622SCHEMBL6836729ZXEVFSPNUIEQJL-UHFFFAOYSA-ZXEVFSPNUIEQJL-UHFFFAOYSA-NN-(3-bromophenyl)-6-methoxypyrido[3,2-d]pyrimidin-4-amine4-(3-bromophenyl) amino-6-methoxypyrido[3,2-d]pyrimidine4-(3-bromophenyl)amino-6-methoxypyrido[3,2-d]pyrimidine4-[(3-bromophenyl)amino]-6-methoxypyrido[3,2-d]pyrimidine
Show more names
InChI=1/C14H11BrN4O/c1-20-12-6-5-11-13(19-12)14(17-8-16-11)18-10-4-2-3-9(15)7-10/h2-8H,1H3,(H,16,17,18)
Database identifiers
- PubChem CID
- 5328279
- ChEMBL
CHEMBL50519
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 59.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 320
Related reactions
7 records
Compound notes
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