3-butyl-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-butyl-6-hydroxy-5-[5-(5-methylthiophen-2-yl)-1-propanoyl-4,5-dihydro-1H-pyrazol-3-yl]pyrimidine-2,4(1H,3H)-dione
3-butyl-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: | D364-1321 |
| Compound Name: | 3-butyl-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: | 404.49 |
| Molecular Formula: | C19 H24 N4 O4 S |
| Smiles: | CCCCN1C(C(=C(NC1=O)O)C1CC(c2ccc(C)s2)N(C(CC)=O)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0767 |
| logD: | -1.9887 |
| logSw: | -3.117 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.54 |
| InChI Key: | ZERGBUUGCGSYBO-ZDUSSCGKSA-N |