N-[3-(3,4-diethoxyphenyl)-1,2-oxazol-5-yl]-3-{[2-(pyridin-2-yl)ethyl]sulfanyl}propanamide
Chemical Structure Depiction of
N-[3-(3,4-diethoxyphenyl)-1,2-oxazol-5-yl]-3-{[2-(pyridin-2-yl)ethyl]sulfanyl}propanamide
N-[3-(3,4-diethoxyphenyl)-1,2-oxazol-5-yl]-3-{[2-(pyridin-2-yl)ethyl]sulfanyl}propanamide
Compound characteristics
| Compound ID: | K783-6846 |
| Compound Name: | N-[3-(3,4-diethoxyphenyl)-1,2-oxazol-5-yl]-3-{[2-(pyridin-2-yl)ethyl]sulfanyl}propanamide |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C23 H27 N3 O4 S |
| Smiles: | CCOc1ccc(cc1OCC)c1cc(NC(CCSCCc2ccccn2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.4714 |
| logD: | 3.471 |
| logSw: | -3.7675 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.361 |
| InChI Key: | WHNLEJYVGKWTAY-UHFFFAOYSA-N |