3-chloro-N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide
Chemical Structure Depiction of
3-chloro-N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide
3-chloro-N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide
Compound characteristics
| Compound ID: | V028-1909 |
| Compound Name: | 3-chloro-N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide |
| Molecular Weight: | 403.95 |
| Molecular Formula: | C19 H18 Cl N3 O S2 |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(CSc2nnc(NC(c3cccc(c3)[Cl])=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.213 |
| logD: | 5.9417 |
| logSw: | -6.3635 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.964 |
| InChI Key: | IKDHTWKVYZSFSD-UHFFFAOYSA-N |