N-(5-{[2-(azepan-1-yl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-N'-cyclohexylurea
Chemical Structure Depiction of
N-(5-{[2-(azepan-1-yl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-N'-cyclohexylurea
N-(5-{[2-(azepan-1-yl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-N'-cyclohexylurea
Compound characteristics
| Compound ID: | G856-9851 |
| Compound Name: | N-(5-{[2-(azepan-1-yl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-N'-cyclohexylurea |
| Molecular Weight: | 397.56 |
| Molecular Formula: | C17 H27 N5 O2 S2 |
| Smiles: | C1CCC(CC1)NC(Nc1nnc(SCC(N2CCCCCC2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7461 |
| logD: | 3.7461 |
| logSw: | -3.7874 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.947 |
| InChI Key: | ZRBPCSPQUZPMOW-UHFFFAOYSA-N |