N-{5-[(phenylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}butanamide
Chemical Structure Depiction of
N-{5-[(phenylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}butanamide
N-{5-[(phenylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}butanamide
Compound characteristics
| Compound ID: | Y031-3408 |
| Compound Name: | N-{5-[(phenylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}butanamide |
| Molecular Weight: | 293.41 |
| Molecular Formula: | C13 H15 N3 O S2 |
| Smiles: | CCCC(Nc1nnc(CSc2ccccc2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2664 |
| logD: | 3.1134 |
| logSw: | -3.3725 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.156 |
| InChI Key: | NFIMEINSDLTHBO-UHFFFAOYSA-N |