N-(5-{[(4-cyanophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopentanecarboxamide
Chemical Structure Depiction of
N-(5-{[(4-cyanophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopentanecarboxamide
N-(5-{[(4-cyanophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopentanecarboxamide
Compound characteristics
| Compound ID: | V015-8439 |
| Compound Name: | N-(5-{[(4-cyanophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclopentanecarboxamide |
| Molecular Weight: | 344.46 |
| Molecular Formula: | C16 H16 N4 O S2 |
| Smiles: | C1CCC(C1)C(Nc1nnc(SCc2ccc(C#N)cc2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7146 |
| logD: | 3.7081 |
| logSw: | -4.0189 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.578 |
| InChI Key: | CRSBIGCLFCYMER-UHFFFAOYSA-N |