N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclobutanecarboxamide
Chemical Structure Depiction of
N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclobutanecarboxamide
N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclobutanecarboxamide
Compound characteristics
| Compound ID: | V013-4917 |
| Compound Name: | N-(5-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclobutanecarboxamide |
| Molecular Weight: | 347.46 |
| Molecular Formula: | C16 H17 N3 O2 S2 |
| Smiles: | Cc1ccc(cc1)C(CSc1nnc(NC(C2CCC2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1498 |
| logD: | 3.1457 |
| logSw: | -3.3215 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.734 |
| InChI Key: | NFOYTDOLBSSLEJ-UHFFFAOYSA-N |