TL;DR: (Z)-3-(3-(benzyloxy)phenyl)-N'-(1-(4-bromophenyl)ethylidene)-1H-pyrazole-5-carbohydrazide (CAS 1310354-00-7) is a chemical compound with molecular formula C25H21BrN4O2 and molecular weight 488.08478 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(Z)-1-(4-bromophenyl)ethylideneamino]-3-(3-phenylmethoxyphenyl)-1H-pyrazole-5-carboxamide
Also Known As: (Z)-3-(3-(benzyloxy)phenyl)-N'-(1-(4-bromophenyl)ethylidene)-1H-pyrazole-5-carbohydrazide, 5-[3-(benzyloxy)phenyl]-N'-[(1Z)-1-(4-bromophenyl)ethylidene]-1H-pyrazole-3-carbohydrazide, N-[(Z)-1-(4-bromophenyl)ethylideneamino]-3-(3-phenylmethoxyphenyl)-1H-pyrazole-5-carboxamide
| Molecular Formula | C25H21BrN4O2 |
| Molecular Weight | 488.08478 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 79.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 488.08478 Da |
| Heavy Atoms | 32 |
| Complexity | 631.0 |
| SMILES | C/C(=N/NC(=O)C1=CC(=NN1)C2=CC(=CC=C2)OCC3=CC=CC=C3)/C4=CC=C(C=C4)Br |
| InChIKey | VLYMHTWTOMIGIQ-PKAZHMFMSA-N |
The XLogP value of 5.5 indicates that (Z)-3-(3-(benzyloxy)phenyl)-N'-(1-(4-bromophenyl)ethylidene)-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 (Z)-3-(3-(benzyloxy)phenyl)-N'-(1-(4-bromophenyl)ethylidene)-1H-pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, (Z)-3-(3-(benzyloxy)phenyl)-N'-(1-(4-bromophenyl)ethylidene)-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 (Z)-3-(3-(benzyloxy)phenyl)-N'-(1-(4-bromophenyl)ethylidene)-1H-pyrazole-5-carbohydrazide is 1310354-00-7.
The molecular formula of (Z)-3-(3-(benzyloxy)phenyl)-N'-(1-(4-bromophenyl)ethylidene)-1H-pyrazole-5-carbohydrazide is C25H21BrN4O2.
The molecular weight of (Z)-3-(3-(benzyloxy)phenyl)-N'-(1-(4-bromophenyl)ethylidene)-1H-pyrazole-5-carbohydrazide is 488.08478 g/mol.
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