4-(2-{[2-(dimethylamino)ethyl]amino}-2-oxoethyl)-N-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
Chemical Structure Depiction of
4-(2-{[2-(dimethylamino)ethyl]amino}-2-oxoethyl)-N-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
4-(2-{[2-(dimethylamino)ethyl]amino}-2-oxoethyl)-N-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide
Compound characteristics
| Compound ID: | G741-0063 |
| Compound Name: | 4-(2-{[2-(dimethylamino)ethyl]amino}-2-oxoethyl)-N-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydroquinoxaline-1(2H)-carboxamide |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C22 H26 F N5 O3 |
| Smiles: | CN(C)CCNC(CN1C(CN(C(NCc2ccc(cc2)F)=O)c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.829 |
| logD: | -0.5058 |
| logSw: | -2.0137 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.538 |
| InChI Key: | PLVFBKDWKZYKDN-UHFFFAOYSA-N |