3-benzyl-6-hydroxy-5-[5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-benzyl-6-hydroxy-5-[5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione
3-benzyl-6-hydroxy-5-[5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D364-0240 |
| Compound Name: | 3-benzyl-6-hydroxy-5-[5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 407.38 |
| Molecular Formula: | C20 H17 N5 O5 |
| Smiles: | C1C(c2cccc(c2)[N+]([O-])=O)NN=C1C1=C(NC(N(Cc2ccccc2)C1=O)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3764 |
| logD: | -3.2336 |
| logSw: | -2.9322 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.353 |
| InChI Key: | ADWLTTSQRSJCIE-HNNXBMFYSA-N |