2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]ethan-1-one
2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | C527-1603 |
| Compound Name: | 2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 511.64 |
| Molecular Formula: | C27 H33 N3 O5 S |
| Smiles: | CC1CN(CCN1c1cccc(C)c1)C(CS(Cc1c(C)oc(c2ccc(c(c2)OC)OC)n1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.348 |
| logD: | 3.3478 |
| logSw: | -3.6139 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.265 |
| InChI Key: | CJFHUOUSCAKXMB-UHFFFAOYSA-N |