N-(2,4-dimethylphenyl)-4-{[(9H-purin-6-yl)sulfanyl]methyl}benzamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-4-{[(9H-purin-6-yl)sulfanyl]methyl}benzamide
N-(2,4-dimethylphenyl)-4-{[(9H-purin-6-yl)sulfanyl]methyl}benzamide
Compound characteristics
| Compound ID: | 7283-0959 |
| Compound Name: | N-(2,4-dimethylphenyl)-4-{[(9H-purin-6-yl)sulfanyl]methyl}benzamide |
| Molecular Weight: | 389.48 |
| Molecular Formula: | C21 H19 N5 O S |
| Smiles: | Cc1ccc(c(C)c1)NC(c1ccc(CSc2c3c(ncn2)[nH]cn3)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2834 |
| logD: | 3.2832 |
| logSw: | -3.3519 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.928 |
| InChI Key: | WYBJTSUOVWBNPK-UHFFFAOYSA-N |