{[2-(azepan-1-yl)-2-oxoethyl]sulfanyl}acetic acid
Chemical Structure Depiction of
{[2-(azepan-1-yl)-2-oxoethyl]sulfanyl}acetic acid
{[2-(azepan-1-yl)-2-oxoethyl]sulfanyl}acetic acid
Compound characteristics
| Compound ID: | Y205-5674 |
| Compound Name: | {[2-(azepan-1-yl)-2-oxoethyl]sulfanyl}acetic acid |
| Molecular Weight: | 231.31 |
| Molecular Formula: | C10 H17 N O3 S |
| Smiles: | C1CCCN(CC1)C(CSCC(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9862 |
| logD: | -2.3824 |
| logSw: | -1.3416 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.346 |
| InChI Key: | CIRINEPDWCIQGR-UHFFFAOYSA-N |