N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide
Compound characteristics
| Compound ID: | C527-0085 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide |
| Molecular Weight: | 416.54 |
| Molecular Formula: | C22 H28 N2 O4 S |
| Smiles: | Cc1c(CS(CC(NCCC2CCCCC=2)=O)=O)nc(c2ccc(cc2)OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.8544 |
| logD: | 2.8544 |
| logSw: | -3.4514 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.182 |
| InChI Key: | PGBPCPVMBMXMAI-UHFFFAOYSA-N |