3-chloro-N-(5-{[(3,5-dimethylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
3-chloro-N-(5-{[(3,5-dimethylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
3-chloro-N-(5-{[(3,5-dimethylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | V010-0852 |
| Compound Name: | 3-chloro-N-(5-{[(3,5-dimethylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 389.92 |
| Molecular Formula: | C18 H16 Cl N3 O S2 |
| Salt: | not_available |
| Smiles: | Cc1cc(C)cc(CSc2nnc(NC(c3cccc(c3)[Cl])=O)s2)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.4265 |
| logD: | 6.1552 |
| logSw: | -6.2847 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.964 |
| InChI Key: | WVUUUIZWQFUFHZ-UHFFFAOYSA-N |