1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}ethan-1-one
Chemical Structure Depiction of
1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}ethan-1-one
1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}ethan-1-one
Compound characteristics
| Compound ID: | C528-0983 |
| Compound Name: | 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}ethan-1-one |
| Molecular Weight: | 497.61 |
| Molecular Formula: | C26 H31 N3 O5 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(CS(Cc1c(C)oc(c2cccc(c2)OC)n1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7029 |
| logD: | 3.7029 |
| logSw: | -4.0251 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.285 |
| InChI Key: | CHLDZBAMVNNVQN-UHFFFAOYSA-N |