N-[3-(butylsulfanyl)propyl]-2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide
Chemical Structure Depiction of
N-[3-(butylsulfanyl)propyl]-2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide
N-[3-(butylsulfanyl)propyl]-2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide
Compound characteristics
| Compound ID: | C527-1714 |
| Compound Name: | N-[3-(butylsulfanyl)propyl]-2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide |
| Molecular Weight: | 468.63 |
| Molecular Formula: | C22 H32 N2 O5 S2 |
| Smiles: | CCCCSCCCNC(CS(Cc1c(C)oc(c2ccc(c(c2)OC)OC)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5778 |
| logD: | 2.5778 |
| logSw: | -2.9871 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.978 |
| InChI Key: | VFNWIXAYOCRAOY-UHFFFAOYSA-N |