2-{[4-amino-5-(3,4-dimethylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(5-chloro-2-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[4-amino-5-(3,4-dimethylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(5-chloro-2-methoxyphenyl)acetamide
2-{[4-amino-5-(3,4-dimethylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(5-chloro-2-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | E682-0108 |
| Compound Name: | 2-{[4-amino-5-(3,4-dimethylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(5-chloro-2-methoxyphenyl)acetamide |
| Molecular Weight: | 493 |
| Molecular Formula: | C21 H21 Cl N4 O4 S2 |
| Smiles: | Cc1ccc(cc1C)S(c1cnc(nc1N)SCC(Nc1cc(ccc1OC)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.845 |
| logD: | 3.8416 |
| logSw: | -4.322 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.061 |
| InChI Key: | HMSRXNOEWKPWHO-UHFFFAOYSA-N |