4-(4-anilino-3-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one
Chemical Structure Depiction of
4-(4-anilino-3-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one
4-(4-anilino-3-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | 1488-2440 |
| Compound Name: | 4-(4-anilino-3-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one |
| Molecular Weight: | 388.38 |
| Molecular Formula: | C21 H16 N4 O4 |
| Smiles: | C1C(Nc2ccccc2N1C(c1ccc(c(c1)[N+]([O-])=O)Nc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7093 |
| logD: | 3.7092 |
| logSw: | -4.2076 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.68 |
| InChI Key: | ZFLPMRCVTFZEQS-UHFFFAOYSA-N |