3-phenyl-N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]propanamide
Chemical Structure Depiction of
3-phenyl-N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]propanamide
3-phenyl-N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]propanamide
Compound characteristics
| Compound ID: | V004-1192 |
| Compound Name: | 3-phenyl-N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]propanamide |
| Molecular Weight: | 397.56 |
| Molecular Formula: | C21 H23 N3 O S2 |
| Smiles: | CC(C)c1ccc(CSc2nnc(NC(CCc3ccccc3)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8266 |
| logD: | 5.8207 |
| logSw: | -5.5234 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.751 |
| InChI Key: | GKSRHJRPUPEYDE-UHFFFAOYSA-N |