N-(5-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(5-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
N-(5-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide
Compound characteristics
| Compound ID: | V015-8968 |
| Compound Name: | N-(5-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)cyclohexanecarboxamide |
| Molecular Weight: | 393.53 |
| Molecular Formula: | C18 H23 N3 O3 S2 |
| Smiles: | COc1cc(CSc2nnc(NC(C3CCCCC3)=O)s2)cc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.7965 |
| logD: | 4.7901 |
| logSw: | -4.478 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.244 |
| InChI Key: | LONOWOOPUDGXHQ-UHFFFAOYSA-N |