N-(2-cyanoethyl)-2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}-N-methylacetamide
Chemical Structure Depiction of
N-(2-cyanoethyl)-2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}-N-methylacetamide
N-(2-cyanoethyl)-2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}-N-methylacetamide
Compound characteristics
| Compound ID: | C528-0977 |
| Compound Name: | N-(2-cyanoethyl)-2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}-N-methylacetamide |
| Molecular Weight: | 391.44 |
| Molecular Formula: | C18 H21 N3 O5 S |
| Smiles: | Cc1c(CS(CC(N(C)CCC#N)=O)(=O)=O)nc(c2cccc(c2)OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 0.6187 |
| logD: | 0.6187 |
| logSw: | -1.9952 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 87.569 |
| InChI Key: | QWRKJKQSUIHIAK-UHFFFAOYSA-N |