N-(3,5-dimethylphenyl)-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
N-(3,5-dimethylphenyl)-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 7472-0010 |
| Compound Name: | N-(3,5-dimethylphenyl)-2-{[3-(pyrrolidin-1-yl)quinoxalin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 392.52 |
| Molecular Formula: | C22 H24 N4 O S |
| Smiles: | Cc1cc(C)cc(c1)NC(CSc1c(nc2ccccc2n1)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3679 |
| logD: | 5.3679 |
| logSw: | -5.2373 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.932 |
| InChI Key: | XRNUCDBFDXFRLM-UHFFFAOYSA-N |