N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanesulfinyl}acetamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanesulfinyl}acetamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanesulfinyl}acetamide
Compound characteristics
| Compound ID: | C527-0745 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanesulfinyl}acetamide |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C22 H28 N2 O3 S |
| Smiles: | Cc1ccc(cc1)c1nc(CS(CC(NCCC2CCCCC=2)=O)=O)c(C)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.2954 |
| logD: | 3.2954 |
| logSw: | -3.5766 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.638 |
| InChI Key: | CBFGFLQKDKNBJP-UHFFFAOYSA-N |