3-[(4-chlorophenyl)sulfanyl]-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}propanamide
Chemical Structure Depiction of
3-[(4-chlorophenyl)sulfanyl]-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}propanamide
3-[(4-chlorophenyl)sulfanyl]-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}propanamide
Compound characteristics
| Compound ID: | Y031-2071 |
| Compound Name: | 3-[(4-chlorophenyl)sulfanyl]-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}propanamide |
| Molecular Weight: | 419.95 |
| Molecular Formula: | C19 H18 Cl N3 O2 S2 |
| Smiles: | COc1ccc(Cc2nnc(NC(CCSc3ccc(cc3)[Cl])=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9553 |
| logD: | 4.9104 |
| logSw: | -4.9634 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.429 |
| InChI Key: | NMMJFVQAZXSAKR-UHFFFAOYSA-N |