N-(3-chloro-4-methylphenyl)-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
N-(3-chloro-4-methylphenyl)-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 7472-0178 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 412.94 |
| Molecular Formula: | C21 H21 Cl N4 O S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSc1c(nc2ccccc2n1)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0651 |
| logD: | 6.0649 |
| logSw: | -6.0342 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.932 |
| InChI Key: | PGDYRGIQBOPHNG-UHFFFAOYSA-N |