3,3-dimethyl-4-(3-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one
Chemical Structure Depiction of
3,3-dimethyl-4-(3-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one
3,3-dimethyl-4-(3-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | 2951-0027 |
| Compound Name: | 3,3-dimethyl-4-(3-nitrobenzoyl)-3,4-dihydroquinoxalin-2(1H)-one |
| Molecular Weight: | 325.32 |
| Molecular Formula: | C17 H15 N3 O4 |
| Smiles: | CC1(C)C(Nc2ccccc2N1C(c1cccc(c1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4253 |
| logD: | 2.4252 |
| logSw: | -3.05 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.486 |
| InChI Key: | SZZKKDWQHSAISY-UHFFFAOYSA-N |