2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}benzoic acid
Chemical Structure Depiction of
2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}benzoic acid
2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}benzoic acid
Compound characteristics
| Compound ID: | 8011-9606 |
| Compound Name: | 2-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}benzoic acid |
| Molecular Weight: | 293.38 |
| Molecular Formula: | C15 H19 N O3 S |
| Smiles: | C1CCC(CC1)NC(CSc1ccccc1C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8632 |
| logD: | 0.2518 |
| logSw: | -3.4023 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.572 |
| InChI Key: | RBEKVRXCSVGTIQ-UHFFFAOYSA-N |