4-(4-methoxybenzoyl)-3,3-dimethyl-1-[(4-nitrophenyl)methyl]-3,4-dihydroquinoxalin-2(1H)-one
Chemical Structure Depiction of
4-(4-methoxybenzoyl)-3,3-dimethyl-1-[(4-nitrophenyl)methyl]-3,4-dihydroquinoxalin-2(1H)-one
4-(4-methoxybenzoyl)-3,3-dimethyl-1-[(4-nitrophenyl)methyl]-3,4-dihydroquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | 2951-0036 |
| Compound Name: | 4-(4-methoxybenzoyl)-3,3-dimethyl-1-[(4-nitrophenyl)methyl]-3,4-dihydroquinoxalin-2(1H)-one |
| Molecular Weight: | 445.47 |
| Molecular Formula: | C25 H23 N3 O5 |
| Smiles: | CC1(C)C(N(Cc2ccc(cc2)[N+]([O-])=O)c2ccccc2N1C(c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2332 |
| logD: | 4.2332 |
| logSw: | -4.3594 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.255 |
| InChI Key: | FNCFYJSQRUKOMO-UHFFFAOYSA-N |