N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide
Chemical Structure Depiction of
N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide
N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide
Compound characteristics
| Compound ID: | C527-1706 |
| Compound Name: | N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}acetamide |
| Molecular Weight: | 561.1 |
| Molecular Formula: | C27 H33 Cl N4 O5 S |
| Smiles: | Cc1c(CS(CC(NCCN2CCN(CC2)c2cccc(c2)[Cl])=O)=O)nc(c2ccc(c(c2)OC)OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.4984 |
| logD: | 2.3943 |
| logSw: | -3.5366 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.95 |
| InChI Key: | YJIJTDHOEWAILI-UHFFFAOYSA-N |