TL;DR: 3-(4-((4-ME-Benzyl)oxy)PH)-N'-(2-thienylmethylene)-1H-pyrazole-5-carbohydrazide (CAS 1285491-05-5) is a chemical compound with molecular formula C23H20N4O2S and molecular weight 416.1307 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-[(4-methylphenyl)methoxy]phenyl]-N-[(E)-thiophen-2-ylmethylideneamino]-1H-pyrazole-5-carboxamide
Also Known As: 5-(4-((4-Methylbenzyl)oxy)phenyl)-N'-(thiophen-2-ylmethylene)-1H-pyrazole-3-carbohydrazide, 3-(4-((4-ME-BENZYL)OXY)PH)-N'-(2-THIENYLMETHYLENE)-1H-PYRAZOLE-5-CARBOHYDRAZIDE, (E)-3-(4-((4-methylbenzyl)oxy)phenyl)-N'-(thiophen-2-ylmethylene)-1H-pyrazole-5-carbohydrazide, 3-[4-[(4-methylphenyl)methoxy]phenyl]-N-[(E)-thiophen-2-ylmethylideneamino]-1H-pyrazole-5-carboxamide, 3-{4-[(4-methylbenzyl)oxy]phenyl}-N'-[(E)-thiophen-2-ylmethylidene]-1H-pyrazole-5-carbohydrazide
| Molecular Formula | C23H20N4O2S |
| Molecular Weight | 416.1307 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 416.1307 Da |
| Heavy Atoms | 30 |
| Complexity | 574.0 |
| SMILES | CC1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NNC(=C3)C(=O)N/N=C/C4=CC=CS4 |
| InChIKey | YEFOVSJSAMPIRR-ZVHZXABRSA-N |
The XLogP value of 5.0 indicates that 3-(4-((4-ME-Benzyl)oxy)PH)-N'-(2-thienylmethylene)-1H-pyrazole-5-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-((4-ME-Benzyl)oxy)PH)-N'-(2-thienylmethylene)-1H-pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, 3-(4-((4-ME-Benzyl)oxy)PH)-N'-(2-thienylmethylene)-1H-pyrazole-5-carbohydrazide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(4-((4-ME-Benzyl)oxy)PH)-N'-(2-thienylmethylene)-1H-pyrazole-5-carbohydrazide is 1285491-05-5.
The molecular formula of 3-(4-((4-ME-Benzyl)oxy)PH)-N'-(2-thienylmethylene)-1H-pyrazole-5-carbohydrazide is C23H20N4O2S.
The molecular weight of 3-(4-((4-ME-Benzyl)oxy)PH)-N'-(2-thienylmethylene)-1H-pyrazole-5-carbohydrazide is 416.1307 g/mol.
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