N-(5-{[(3,5-dimethylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
Chemical Structure Depiction of
N-(5-{[(3,5-dimethylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
N-(5-{[(3,5-dimethylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
Compound characteristics
| Compound ID: | V018-0069 |
| Compound Name: | N-(5-{[(3,5-dimethylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide |
| Molecular Weight: | 319.45 |
| Molecular Formula: | C15 H17 N3 O S2 |
| Smiles: | Cc1cc(C)cc(CSc2nnc(NC(C3CC3)=O)s2)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.0253 |
| logD: | 5.0238 |
| logSw: | -4.6032 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.487 |
| InChI Key: | JLUAELYVTYSVTP-UHFFFAOYSA-N |