N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopentanecarboxamide
Chemical Structure Depiction of
N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopentanecarboxamide
N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopentanecarboxamide
Compound characteristics
| Compound ID: | V012-0940 |
| Compound Name: | N-(5-{[(4-tert-butylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopentanecarboxamide |
| Molecular Weight: | 375.55 |
| Molecular Formula: | C19 H25 N3 O S2 |
| Smiles: | CC(C)(C)c1ccc(CSc2nnc(NC(C3CCCC3)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8546 |
| logD: | 5.8482 |
| logSw: | -5.3828 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.522 |
| InChI Key: | HIPZVZOTBAPENS-UHFFFAOYSA-N |