N-(4-{[6-chloro-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-yl]amino}phenyl)propanamide
Chemical Structure Depiction of
N-(4-{[6-chloro-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-yl]amino}phenyl)propanamide
N-(4-{[6-chloro-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-yl]amino}phenyl)propanamide
Compound characteristics
| Compound ID: | C301-3041 |
| Compound Name: | N-(4-{[6-chloro-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-yl]amino}phenyl)propanamide |
| Molecular Weight: | 420.9 |
| Molecular Formula: | C22 H21 Cl N6 O |
| Smiles: | CCC(Nc1ccc(cc1)Nc1c(nc2cc(ccc2n1)[Cl])n1c(C)cc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6061 |
| logD: | 4.6051 |
| logSw: | -4.4726 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.678 |
| InChI Key: | BIEDUNPXNWANIP-UHFFFAOYSA-N |