N-(5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide
Chemical Structure Depiction of
N-(5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide
N-(5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide
Compound characteristics
| Compound ID: | V015-5915 |
| Compound Name: | N-(5-{[(3,4-dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide |
| Molecular Weight: | 362.3 |
| Molecular Formula: | C13 H13 Cl2 N3 O S2 |
| Smiles: | CCCC(Nc1nnc(SCc2ccc(c(c2)[Cl])[Cl])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0623 |
| logD: | 5.0599 |
| logSw: | -5.292 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.022 |
| InChI Key: | UMBYQZKVIASTSV-UHFFFAOYSA-N |