5-[5-(2H-1,3-benzodioxol-5-yl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
5-[5-(2H-1,3-benzodioxol-5-yl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
5-[5-(2H-1,3-benzodioxol-5-yl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D364-1206 |
| Compound Name: | 5-[5-(2H-1,3-benzodioxol-5-yl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-1,3-dimethylpyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 400.39 |
| Molecular Formula: | C19 H20 N4 O6 |
| Smiles: | CCC(N1C(CC(C2=C(N(C)C(N(C)C2=O)=O)O)=N1)c1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7092 |
| logD: | -2.5331 |
| logSw: | -2.0141 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.948 |
| InChI Key: | PRJJEZQVDAVOTB-GFCCVEGCSA-N |