N-(5-chloro-2,4-dimethoxyphenyl)-2-{[1-(4-methoxybenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-{[1-(4-methoxybenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamide
N-(5-chloro-2,4-dimethoxyphenyl)-2-{[1-(4-methoxybenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | K653-0640 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-{[1-(4-methoxybenzene-1-sulfonyl)-1H-benzimidazol-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 548.04 |
| Molecular Formula: | C24 H22 Cl N3 O6 S2 |
| Smiles: | COc1ccc(cc1)S(n1c2ccccc2nc1SCC(Nc1cc(c(cc1OC)OC)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8649 |
| logD: | 4.8577 |
| logSw: | -4.9918 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.12 |
| InChI Key: | IQVRUSQNGXNKJT-UHFFFAOYSA-N |