N-[4-(propan-2-yl)phenyl]-2-[(9H-purin-6-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[4-(propan-2-yl)phenyl]-2-[(9H-purin-6-yl)sulfanyl]acetamide
N-[4-(propan-2-yl)phenyl]-2-[(9H-purin-6-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D691-0022 |
| Compound Name: | N-[4-(propan-2-yl)phenyl]-2-[(9H-purin-6-yl)sulfanyl]acetamide |
| Molecular Weight: | 327.41 |
| Molecular Formula: | C16 H17 N5 O S |
| Smiles: | CC(C)c1ccc(cc1)NC(CSc1c2c(ncn1)[nH]cn2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7852 |
| logD: | 2.785 |
| logSw: | -3.318 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.684 |
| InChI Key: | AIBZLQDOGGTSPN-UHFFFAOYSA-N |