N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(thiophen-2-yl)acetamide
Chemical Structure Depiction of
N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(thiophen-2-yl)acetamide
N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(thiophen-2-yl)acetamide
Compound characteristics
| Compound ID: | V015-3002 |
| Compound Name: | N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(thiophen-2-yl)acetamide |
| Molecular Weight: | 403.59 |
| Molecular Formula: | C19 H21 N3 O S3 |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(CSc2nnc(NC(Cc3cccs3)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3196 |
| logD: | 5.3171 |
| logSw: | -5.3038 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.769 |
| InChI Key: | IGMUEEJWQIOFOJ-UHFFFAOYSA-N |