3-butyl-5-[5-(2,5-dimethoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxypyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-butyl-5-[5-(2,5-dimethoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxypyrimidine-2,4(1H,3H)-dione
3-butyl-5-[5-(2,5-dimethoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxypyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D364-1300 |
| Compound Name: | 3-butyl-5-[5-(2,5-dimethoxyphenyl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxypyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 444.49 |
| Molecular Formula: | C22 H28 N4 O6 |
| Smiles: | CCCCN1C(C(=C(NC1=O)O)C1CC(c2cc(ccc2OC)OC)N(C(CC)=O)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9119 |
| logD: | -2.1534 |
| logSw: | -3.2494 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.696 |
| InChI Key: | VVTIWNHHDTYUBR-MRXNPFEDSA-N |