1-benzyl-3,3-dimethyl-4-(3-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one
Chemical Structure Depiction of
1-benzyl-3,3-dimethyl-4-(3-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one
1-benzyl-3,3-dimethyl-4-(3-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | 2951-0020 |
| Compound Name: | 1-benzyl-3,3-dimethyl-4-(3-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one |
| Molecular Weight: | 415.45 |
| Molecular Formula: | C24 H21 N3 O4 |
| Smiles: | CC1(C)C(N(Cc2ccccc2)c2ccccc2N1C(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.187 |
| logD: | 4.187 |
| logSw: | -4.4204 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.711 |
| InChI Key: | HPKRDVXXPKJYRN-UHFFFAOYSA-N |