4-benzoyl-1-(2,2-dimethoxyethyl)-3-hydroxy-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
4-benzoyl-1-(2,2-dimethoxyethyl)-3-hydroxy-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
4-benzoyl-1-(2,2-dimethoxyethyl)-3-hydroxy-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 8015-6029 |
| Compound Name: | 4-benzoyl-1-(2,2-dimethoxyethyl)-3-hydroxy-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 412.4 |
| Molecular Formula: | C21 H20 N2 O7 |
| Smiles: | COC(CN1C(C(=C(C1=O)O)C(c1ccccc1)=O)c1ccc(cc1)[N+]([O-])=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1147 |
| logD: | 2.1123 |
| logSw: | -2.6052 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.974 |
| InChI Key: | JXPXOUJQEMHIMC-GOSISDBHSA-N |