Basic information
- Standard SMILES
c1ccc(Nc2nc(Nc3ccc(-c4cnco4)cc3)nc3c2CNCC3)cc1- InChIKey
ZQHDFLRQWVGDIK-UHFFFAOYSA-N- Molecular formula
- C22H20N6O
- Average molar mass
- 384.4 g/mol
Names & identifiers
- Preferred name
- N2-(4-(oxazol-5-yl)phenyl)-N4-phenyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine-2,4-diamine
- IUPAC
- 2-N-[4-(1,3-oxazol-5-yl)phenyl]-4-N-phenyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine-2,4-diamine
Names & synonyms
SCHEMBL2450338ZQHDFLRQWVGDIK-UHFFFAOYSA-NN2-(4-(oxazol-5-yl)phenyl)-N4-phenyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine-2,4-diamine
Database identifiers
- PubChem CID
- 46200052
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 87.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 508
Related reactions
2 records
Compound notes
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