5-[1-acetyl-5-(5-methylthiophen-2-yl)-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-3-(2-methoxyphenyl)pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
5-[1-acetyl-5-(5-methylthiophen-2-yl)-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-3-(2-methoxyphenyl)pyrimidine-2,4(1H,3H)-dione
5-[1-acetyl-5-(5-methylthiophen-2-yl)-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-3-(2-methoxyphenyl)pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D364-0971 |
| Compound Name: | 5-[1-acetyl-5-(5-methylthiophen-2-yl)-4,5-dihydro-1H-pyrazol-3-yl]-6-hydroxy-3-(2-methoxyphenyl)pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 440.48 |
| Molecular Formula: | C21 H20 N4 O5 S |
| Smiles: | CC(N1C(CC(C2=C(NC(N(C2=O)c2ccccc2OC)=O)O)=N1)c1ccc(C)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1073 |
| logD: | -3.3251 |
| logSw: | -2.7103 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.003 |
| InChI Key: | YJNWETSJINYOJS-HNNXBMFYSA-N |