4-acetyl-3-hydroxy-1-(hydroxymethyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
4-acetyl-3-hydroxy-1-(hydroxymethyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
4-acetyl-3-hydroxy-1-(hydroxymethyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 4530-7006 |
| Compound Name: | 4-acetyl-3-hydroxy-1-(hydroxymethyl)-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 292.25 |
| Molecular Formula: | C13 H12 N2 O6 |
| Smiles: | CC(C1C(c2cccc(c2)[N+]([O-])=O)N(CO)C(C=1O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.2491 |
| logD: | 0.2222 |
| logSw: | -1.5511 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.863 |
| InChI Key: | VMIBBQIGHBTZDM-LLVKDONJSA-N |