N-(2-methoxy-5-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-methoxy-5-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
N-(2-methoxy-5-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D691-0125 |
| Compound Name: | N-(2-methoxy-5-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide |
| Molecular Weight: | 329.38 |
| Molecular Formula: | C15 H15 N5 O2 S |
| Smiles: | Cc1ccc(c(c1)NC(CSc1c2c(ncn1)[nH]cn2)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.2839 |
| logD: | 1.2837 |
| logSw: | -2.4139 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.617 |
| InChI Key: | HKXMZISEEFERSC-UHFFFAOYSA-N |