2-chloro-N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
2-chloro-N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
2-chloro-N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | V010-1879 |
| Compound Name: | 2-chloro-N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 403.91 |
| Molecular Formula: | C18 H14 Cl N3 O2 S2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(CSc1nnc(NC(c2ccccc2[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8932 |
| logD: | 4.6024 |
| logSw: | -4.8279 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.211 |
| InChI Key: | YJNUTFHGQUZPQW-UHFFFAOYSA-N |