propan-2-yl {[4,6-dimethyl-3-(phenylcarbamoyl)pyridin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
propan-2-yl {[4,6-dimethyl-3-(phenylcarbamoyl)pyridin-2-yl]sulfanyl}acetate
propan-2-yl {[4,6-dimethyl-3-(phenylcarbamoyl)pyridin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D276-0051 |
| Compound Name: | propan-2-yl {[4,6-dimethyl-3-(phenylcarbamoyl)pyridin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 358.46 |
| Molecular Formula: | C19 H22 N2 O3 S |
| Smiles: | CC(C)OC(CSc1c(C(Nc2ccccc2)=O)c(C)cc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8421 |
| logD: | 3.8412 |
| logSw: | -4.1372 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.721 |
| InChI Key: | UQRIPTBPAZUGFO-UHFFFAOYSA-N |