3-(3-chlorophenyl)-6-hydroxy-5-[5-(5-methylthiophen-2-yl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-(3-chlorophenyl)-6-hydroxy-5-[5-(5-methylthiophen-2-yl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione
3-(3-chlorophenyl)-6-hydroxy-5-[5-(5-methylthiophen-2-yl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | D364-1636 |
| Compound Name: | 3-(3-chlorophenyl)-6-hydroxy-5-[5-(5-methylthiophen-2-yl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 458.92 |
| Molecular Formula: | C21 H19 Cl N4 O4 S |
| Smiles: | CCC(N1C(CC(C2=C(NC(N(C2=O)c2cccc(c2)[Cl])=O)O)=N1)c1ccc(C)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4148 |
| logD: | -2.0175 |
| logSw: | -3.5687 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.678 |
| InChI Key: | KPBAMIMKGLHMRR-OAHLLOKOSA-N |