N-(3-chloro-2-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
N-(3-chloro-2-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D691-0011 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide |
| Molecular Weight: | 333.8 |
| Molecular Formula: | C14 H12 Cl N5 O S |
| Smiles: | Cc1c(cccc1[Cl])NC(CSc1c2c(ncn1)[nH]cn2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2543 |
| logD: | 2.2541 |
| logSw: | -3.0342 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.986 |
| InChI Key: | IXLVULBJUYFMPI-UHFFFAOYSA-N |