3-[(4-chloro-3-nitrophenyl)methyl]-7-nitroquinoxalin-2(1H)-one
Chemical Structure Depiction of
3-[(4-chloro-3-nitrophenyl)methyl]-7-nitroquinoxalin-2(1H)-one
3-[(4-chloro-3-nitrophenyl)methyl]-7-nitroquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | 3764-6731 |
| Compound Name: | 3-[(4-chloro-3-nitrophenyl)methyl]-7-nitroquinoxalin-2(1H)-one |
| Molecular Weight: | 360.71 |
| Molecular Formula: | C15 H9 Cl N4 O5 |
| Smiles: | C(C1C(Nc2cc(ccc2N=1)[N+]([O-])=O)=O)c1ccc(c(c1)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.01 |
| logD: | 3.0098 |
| logSw: | -3.6289 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.319 |
| InChI Key: | DZIKUJXKMRFTNO-UHFFFAOYSA-N |