4-({2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1-ethylquinolin-2(1H)-one
Chemical Structure Depiction of
4-({2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1-ethylquinolin-2(1H)-one
4-({2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1-ethylquinolin-2(1H)-one
Compound characteristics
| Compound ID: | C564-0178 |
| Compound Name: | 4-({2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1-ethylquinolin-2(1H)-one |
| Molecular Weight: | 435.59 |
| Molecular Formula: | C25 H29 N3 O2 S |
| Smiles: | CCN1C(C=C(c2ccccc12)SCC(N1CCN(CC1)c1cc(C)ccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2701 |
| logD: | 4.2701 |
| logSw: | -4.2748 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.695 |
| InChI Key: | NJHPHTSKVPVDNU-UHFFFAOYSA-N |