4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-(4-fluorophenyl)-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
Chemical Structure Depiction of
4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-(4-fluorophenyl)-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-(4-fluorophenyl)-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
Compound characteristics
| Compound ID: | G741-1239 |
| Compound Name: | 4-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-N-(4-fluorophenyl)-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide |
| Molecular Weight: | 476.46 |
| Molecular Formula: | C25 H21 F N4 O5 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CN1C(CN(C(Nc2ccc(cc2)F)=O)c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.956 |
| logD: | 2.956 |
| logSw: | -3.4018 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.352 |
| InChI Key: | KIDILSYIFUDUMD-UHFFFAOYSA-N |