TL;DR: 3-[4-[(2-chlorophenyl)methoxy]phenyl]-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide (CAS 1359974-09-6) is a chemical compound with molecular formula C31H25ClN4O3 and molecular weight 536.1615 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[4-[(2-chlorophenyl)methoxy]phenyl]-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide
Also Known As: 3-[4-[(2-chlorophenyl)methoxy]phenyl]-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide, N'-{(E)-[4-(BENZYLOXY)PHENYL]METHYLIDENE}-3-{4-[(2-CHLOROBENZYL)OXY]PHENYL}-1H-PYRAZOLE-5-CARBOHYDRAZIDE, N'-{(Z)-[4-(benzyloxy)phenyl]methylidene}-3-{4-[(2-chlorobenzyl)oxy]phenyl}-1H-pyrazole-5-carbohydrazide, N-{(1Z)-2-[4-(phenylmethoxy)phenyl]-1-azavinyl}(3-{4-[(2-chlorophenyl)methoxy] phenyl}pyrazol-5-yl)carboxamide
| Molecular Formula | C31H25ClN4O3 |
| Molecular Weight | 536.1615 g/mol |
| XLogP | 6.7 |
| Topological Polar Surface Area (TPSA) | 88.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 536.1615 Da |
| Heavy Atoms | 39 |
| Complexity | 763.0 |
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N\NC(=O)C3=CC(=NN3)C4=CC=C(C=C4)OCC5=CC=CC=C5Cl |
| InChIKey | ASSCCUDTPOQNDJ-APTWKGOFSA-N |
The XLogP value of 6.7 indicates that 3-[4-[(2-chlorophenyl)methoxy]phenyl]-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-[(2-chlorophenyl)methoxy]phenyl]-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide. Following Lipinski's Rule of Five, 3-[4-[(2-chlorophenyl)methoxy]phenyl]-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 3-[4-[(2-chlorophenyl)methoxy]phenyl]-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide is 1359974-09-6.
The molecular formula of 3-[4-[(2-chlorophenyl)methoxy]phenyl]-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide is C31H25ClN4O3.
The molecular weight of 3-[4-[(2-chlorophenyl)methoxy]phenyl]-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide is 536.1615 g/mol.
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