TL;DR: ME 4-(2-((3-(4-Butoxyphenyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate (CAS 1359880-53-7) is a chemical compound with molecular formula C23H24N4O4 and molecular weight 420.17975 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[(E)-[[3-(4-butoxyphenyl)-1H-pyrazole-5-carbonyl]hydrazinylidene]methyl]benzoate
Also Known As: ME 4-(2-((3-(4-BUTOXYPHENYL)-1H-PYRAZOL-5-YL)CARBONYL)CARBOHYDRAZONOYL)BENZOATE, Methyl 4-((2-(5-(4-butoxyphenyl)-1H-pyrazole-3-carbonyl)hydrazono)methyl)benzoate, (E)-methyl 4-((2-(3-(4-butoxyphenyl)-1H-pyrazole-5-carbonyl)hydrazono)methyl)benzoate, methyl 4-[(E)-[[3-(4-butoxyphenyl)-1H-pyrazole-5-carbonyl]hydrazinylidene]methyl]benzoate, 655-499-3
| Molecular Formula | C23H24N4O4 |
| Molecular Weight | 420.17975 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 420.17975 Da |
| Heavy Atoms | 31 |
| Complexity | 598.0 |
| SMILES | CCCCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N/N=C/C3=CC=C(C=C3)C(=O)OC |
| InChIKey | ZNAPYBSEGZZARO-BUVRLJJBSA-N |
The XLogP value of 4.2 indicates that ME 4-(2-((3-(4-Butoxyphenyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ME 4-(2-((3-(4-Butoxyphenyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate. Following Lipinski's Rule of Five, ME 4-(2-((3-(4-Butoxyphenyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of ME 4-(2-((3-(4-Butoxyphenyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate is 1359880-53-7.
The molecular formula of ME 4-(2-((3-(4-Butoxyphenyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate is C23H24N4O4.
The molecular weight of ME 4-(2-((3-(4-Butoxyphenyl)-1H-pyrazol-5-YL)carbonyl)carbohydrazonoyl)benzoate is 420.17975 g/mol.
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