2-{[4-amino-5-(3,4-dimethylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(5-chloro-2-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[4-amino-5-(3,4-dimethylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(5-chloro-2-methylphenyl)acetamide
2-{[4-amino-5-(3,4-dimethylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(5-chloro-2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | E682-0093 |
| Compound Name: | 2-{[4-amino-5-(3,4-dimethylbenzene-1-sulfonyl)pyrimidin-2-yl]sulfanyl}-N-(5-chloro-2-methylphenyl)acetamide |
| Molecular Weight: | 477 |
| Molecular Formula: | C21 H21 Cl N4 O3 S2 |
| Smiles: | Cc1ccc(cc1C)S(c1cnc(nc1N)SCC(Nc1cc(ccc1C)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0493 |
| logD: | 4.0491 |
| logSw: | -4.3506 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.431 |
| InChI Key: | IKXDWQMDTWKDBI-UHFFFAOYSA-N |