2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]-N-[4-(propan-2-yl)phenyl]butanamide
Chemical Structure Depiction of
2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]-N-[4-(propan-2-yl)phenyl]butanamide
2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]-N-[4-(propan-2-yl)phenyl]butanamide
Compound characteristics
| Compound ID: | J095-0017 |
| Compound Name: | 2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]-N-[4-(propan-2-yl)phenyl]butanamide |
| Molecular Weight: | 385.49 |
| Molecular Formula: | C19 H23 N5 O2 S |
| Smiles: | CCC(C(Nc1ccc(cc1)C(C)C)=O)Sc1nc2C(NC=Nc2n1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2407 |
| logD: | 3.2401 |
| logSw: | -3.6321 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.875 |
| InChI Key: | LBBHWQWQLGTRIC-AWEZNQCLSA-N |