methyl 4-{[3-(pyrrolidin-1-yl)quinoxaline-2-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[3-(pyrrolidin-1-yl)quinoxaline-2-carbonyl]amino}benzoate
methyl 4-{[3-(pyrrolidin-1-yl)quinoxaline-2-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | G934-0051 |
| Compound Name: | methyl 4-{[3-(pyrrolidin-1-yl)quinoxaline-2-carbonyl]amino}benzoate |
| Molecular Weight: | 376.41 |
| Molecular Formula: | C21 H20 N4 O3 |
| Smiles: | COC(c1ccc(cc1)NC(c1c(nc2ccccc2n1)N1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2147 |
| logD: | 4.1979 |
| logSw: | -4.1911 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.958 |
| InChI Key: | RGYQPOREQKALHN-UHFFFAOYSA-N |