Basic information
- Standard SMILES
CCN(CC1CCCO1)c1nc(Nc2ccc(-c3cnco3)cc2)nc2c1CN(CCO)CC2- InChIKey
BJHHLYJBGNTFSV-UHFFFAOYSA-N- Molecular formula
- C25H32N6O3
- Average molar mass
- 464.6 g/mol
Names & identifiers
- Preferred name
- 2-(4-(ethyl((tetrahydrofuran-2-yl)methyl)amino)-2-(4-(oxazol-5-yl)phenylamino)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl)ethanol
- IUPAC
- 2-[4-[ethyl(oxolan-2-ylmethyl)amino]-2-[4-(1,3-oxazol-5-yl)anilino]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]ethanol
Names & synonyms
SCHEMBL2444124BJHHLYJBGNTFSV-UHFFFAOYSA-N2-(4-(ethyl((tetrahydrofuran-2-yl)methyl)amino)-2-(4-(oxazol-5-yl)phenylamino)-7,8-dihydropyrido[4,3-d]pyrimidin-6(5H)-yl)ethanol
Database identifiers
- PubChem CID
- 46199741
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 99.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 9
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 621
Related reactions
1 records
Compound notes
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