TL;DR: 3-[4-(pentyloxy)phenyl]-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-1H-pyrazole-5-carbohydrazide (CAS 1285523-54-7) is a chemical compound with molecular formula C24H26N4O2 and molecular weight 402.20557 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-pentoxyphenyl)-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]-1H-pyrazole-5-carboxamide
Also Known As: 3-[4-(pentyloxy)phenyl]-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-1H-pyrazole-5-carbohydrazide, (E)-3-(4-(pentyloxy)phenyl)-N'-((E)-3-phenylallylidene)-1H-pyrazole-5-carbohydrazide, 3-(4-pentoxyphenyl)-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]-1H-pyrazole-5-carboxamide, N-((1E,3E)-4-phenyl-1-azabuta-1,3-dienyl)[3-(4-pentyloxyphenyl)pyrazol-5-yl]ca rboxamide
| Molecular Formula | C24H26N4O2 |
| Molecular Weight | 402.20557 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 79.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 402.20557 Da |
| Heavy Atoms | 30 |
| Complexity | 551.0 |
| SMILES | CCCCCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N/N=C/C=C/C3=CC=CC=C3 |
| InChIKey | HLFGZPJVULSMLB-IZAVNHFDSA-N |
The XLogP value of 5.3 indicates that 3-[4-(pentyloxy)phenyl]-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-1H-pyrazole-5-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-(pentyloxy)phenyl]-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-1H-pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, 3-[4-(pentyloxy)phenyl]-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-1H-pyrazole-5-carbohydrazide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3-[4-(pentyloxy)phenyl]-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-1H-pyrazole-5-carbohydrazide is 1285523-54-7.
The molecular formula of 3-[4-(pentyloxy)phenyl]-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-1H-pyrazole-5-carbohydrazide is C24H26N4O2.
The molecular weight of 3-[4-(pentyloxy)phenyl]-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]-1H-pyrazole-5-carbohydrazide is 402.20557 g/mol.
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