N-(3-acetylphenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]butanamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]butanamide
N-(3-acetylphenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]butanamide
Compound characteristics
| Compound ID: | D585-0584 |
| Compound Name: | N-(3-acetylphenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]butanamide |
| Molecular Weight: | 371.42 |
| Molecular Formula: | C17 H17 N5 O3 S |
| Smiles: | CCC(C(Nc1cccc(c1)C(C)=O)=O)Sc1nc(c2c(n1)[nH]cn2)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9195 |
| logD: | 1.3801 |
| logSw: | -2.5809 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.036 |
| InChI Key: | BPJKCCCOYIAZDK-LBPRGKRZSA-N |