N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]pentanamide
Chemical Structure Depiction of
N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]pentanamide
N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]pentanamide
Compound characteristics
| Compound ID: | V002-7432 |
| Compound Name: | N-[5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]pentanamide |
| Molecular Weight: | 349.52 |
| Molecular Formula: | C17 H23 N3 O S2 |
| Smiles: | CCCCC(Nc1nnc(SCc2ccc(cc2)C(C)C)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1391 |
| logD: | 5.1368 |
| logSw: | -4.8912 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.022 |
| InChI Key: | PFUKZOSWZVMUJU-UHFFFAOYSA-N |