6-hydroxy-5-[5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-(2-phenylethyl)pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-hydroxy-5-[5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-(2-phenylethyl)pyrimidine-2,4(1H,3H)-dione
6-hydroxy-5-[5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-(2-phenylethyl)pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D364-0275 |
| Compound Name: | 6-hydroxy-5-[5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-(2-phenylethyl)pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 421.41 |
| Molecular Formula: | C21 H19 N5 O5 |
| Smiles: | C(CN1C(C(=C(NC1=O)O)C1CC(c2cccc(c2)[N+]([O-])=O)NN=1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5242 |
| logD: | -2.7378 |
| logSw: | -2.9087 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.332 |
| InChI Key: | UDNHJIGKGYLLIP-INIZCTEOSA-N |