TL;DR: 2-(4-butylphenoxy)-N-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]acetamide (CAS 1007519-48-3) is a chemical compound with molecular formula C31H34N4O3 and molecular weight 510.2631 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-butylphenoxy)-N-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]acetamide
Also Known As: 2-(4-butylphenoxy)-N-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]acetamide, 2-(4-Butylphenoxy)acetic acid 2-[[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylene]hydrazide, 2-(4-Butylphenoxy)-N'-{[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}acetohydrazide
| Molecular Formula | C31H34N4O3 |
| Molecular Weight | 510.2631 g/mol |
| XLogP | 7.2 |
| Topological Polar Surface Area (TPSA) | 77.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 510.2631 Da |
| Heavy Atoms | 38 |
| Complexity | 697.0 |
| SMILES | CCCCC1=CC=C(C=C1)OCC(=O)NN=CC2=CN(N=C2C3=CC=C(C=C3)OCCC)C4=CC=CC=C4 |
| InChIKey | WUBYUOMSFXMIJK-UHFFFAOYSA-N |
The XLogP value of 7.2 indicates that 2-(4-butylphenoxy)-N-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-butylphenoxy)-N-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]acetamide. Following Lipinski's Rule of Five, 2-(4-butylphenoxy)-N-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]acetamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(4-butylphenoxy)-N-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]acetamide is 1007519-48-3.
The molecular formula of 2-(4-butylphenoxy)-N-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]acetamide is C31H34N4O3.
The molecular weight of 2-(4-butylphenoxy)-N-[[1-phenyl-3-(4-propoxyphenyl)pyrazol-4-yl]methylideneamino]acetamide is 510.2631 g/mol.
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