3-chloro-N-(5-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
3-chloro-N-(5-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
3-chloro-N-(5-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | V014-4587 |
| Compound Name: | 3-chloro-N-(5-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 421.92 |
| Molecular Formula: | C18 H16 Cl N3 O3 S2 |
| Salt: | not_available |
| Smiles: | COc1cc(CSc2nnc(NC(c3cccc(c3)[Cl])=O)s2)cc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.2771 |
| logD: | 5.0059 |
| logSw: | -5.8635 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.052 |
| InChI Key: | IJXNLPUXKOPPAV-UHFFFAOYSA-N |