3-[3-hydroxy-4-(4-methylbenzoyl)-5-(3-nitrophenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
Chemical Structure Depiction of
3-[3-hydroxy-4-(4-methylbenzoyl)-5-(3-nitrophenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
3-[3-hydroxy-4-(4-methylbenzoyl)-5-(3-nitrophenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
Compound characteristics
| Compound ID: | 4393-0355 |
| Compound Name: | 3-[3-hydroxy-4-(4-methylbenzoyl)-5-(3-nitrophenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid |
| Molecular Weight: | 410.38 |
| Molecular Formula: | C21 H18 N2 O7 |
| Smiles: | Cc1ccc(cc1)C(C1C(c2cccc(c2)[N+]([O-])=O)N(CCC(O)=O)C(C=1O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.979 |
| logD: | -0.7166 |
| logSw: | -2.4403 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.842 |
| InChI Key: | UKJPAXWHNNPPNI-GOSISDBHSA-N |