N-(3,4-dimethylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
N-(3,4-dimethylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D691-0021 |
| Compound Name: | N-(3,4-dimethylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide |
| Molecular Weight: | 313.38 |
| Molecular Formula: | C15 H15 N5 O S |
| Smiles: | Cc1ccc(cc1C)NC(CSc1c2c(ncn1)[nH]cn2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4344 |
| logD: | 2.4342 |
| logSw: | -2.7666 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.684 |
| InChI Key: | YBJOQCJADWXODL-UHFFFAOYSA-N |