N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
Chemical Structure Depiction of
N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide
Compound characteristics
| Compound ID: | V018-5355 |
| Compound Name: | N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopropanecarboxamide |
| Molecular Weight: | 347.5 |
| Molecular Formula: | C17 H21 N3 O S2 |
| Smiles: | CC(C)(C)c1ccc(CSc2nnc(NC(C3CC3)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2681 |
| logD: | 5.2666 |
| logSw: | -5.1848 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.487 |
| InChI Key: | ZMCLTEKYNOWFBT-UHFFFAOYSA-N |