ethyl 1-{4-[(6-acetyl-2H-1,3-benzodioxol-5-yl)carbamoyl]phenyl}-5-amino-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[(6-acetyl-2H-1,3-benzodioxol-5-yl)carbamoyl]phenyl}-5-amino-1H-pyrazole-4-carboxylate
ethyl 1-{4-[(6-acetyl-2H-1,3-benzodioxol-5-yl)carbamoyl]phenyl}-5-amino-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | G892-0174 |
| Compound Name: | ethyl 1-{4-[(6-acetyl-2H-1,3-benzodioxol-5-yl)carbamoyl]phenyl}-5-amino-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 436.42 |
| Molecular Formula: | C22 H20 N4 O6 |
| Smiles: | CCOC(c1cnn(c2ccc(cc2)C(Nc2cc3c(cc2C(C)=O)OCO3)=O)c1N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7723 |
| logD: | 1.8607 |
| logSw: | -3.1732 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.644 |
| InChI Key: | PQBXRSVHNLQCLD-UHFFFAOYSA-N |