N-(5-chloro-2,4-dimethoxyphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
N-(5-chloro-2,4-dimethoxyphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D691-0060 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide |
| Molecular Weight: | 379.82 |
| Molecular Formula: | C15 H14 Cl N5 O3 S |
| Smiles: | COc1cc(c(cc1NC(CSc1c2c(ncn1)[nH]cn2)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 1.7458 |
| logD: | 1.7371 |
| logSw: | -2.8119 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.247 |
| InChI Key: | MCBXEIITYVVQOQ-UHFFFAOYSA-N |