3-({2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1-methylquinoxalin-2(1H)-one
Chemical Structure Depiction of
3-({2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1-methylquinoxalin-2(1H)-one
3-({2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1-methylquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | F680-0417 |
| Compound Name: | 3-({2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1-methylquinoxalin-2(1H)-one |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C23 H26 N4 O2 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(CSC1C(N(C)c2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2081 |
| logD: | 3.208 |
| logSw: | -3.3856 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.987 |
| InChI Key: | PULPUGFQRDXLIO-UHFFFAOYSA-N |