TL;DR: 3-(2,5-dichlorophenyl)-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-1H-pyrazole-5-carbohydrazide (CAS 1284268-87-6) is a chemical compound with molecular formula C19H17Cl2N5O and molecular weight 401.08102 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2,5-dichlorophenyl)-N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-1H-pyrazole-5-carboxamide
Also Known As: 3-(2,5-dichlorophenyl)-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-1H-pyrazole-5-carbohydrazide, (E)-3-(2,5-dichlorophenyl)-N'-(4-(dimethylamino)benzylidene)-1H-pyrazole-5-carbohydrazide, 3-(2,5-dichlorophenyl)-N-[(E)-(4-dimethylaminophenyl)methylideneamino]-1H-pyrazole-5-carboxamide, N-{(1E)-2-[4-(dimethylamino)phenyl]-1-azavinyl}[3-(2,5-dichlorophenyl)pyrazol- 5-yl]carboxamide
| Molecular Formula | C19H17Cl2N5O |
| Molecular Weight | 401.08102 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 73.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.08102 Da |
| Heavy Atoms | 27 |
| Complexity | 524.0 |
| SMILES | CN(C)C1=CC=C(C=C1)/C=N/NC(=O)C2=CC(=NN2)C3=C(C=CC(=C3)Cl)Cl |
| InChIKey | VGQWXJLLDZIKFQ-SSDVNMTOSA-N |
The XLogP value of 4.5 indicates that 3-(2,5-dichlorophenyl)-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-1H-pyrazole-5-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,5-dichlorophenyl)-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-1H-pyrazole-5-carbohydrazide. Following Lipinski's Rule of Five, 3-(2,5-dichlorophenyl)-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-1H-pyrazole-5-carbohydrazide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(2,5-dichlorophenyl)-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-1H-pyrazole-5-carbohydrazide is 1284268-87-6.
The molecular formula of 3-(2,5-dichlorophenyl)-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-1H-pyrazole-5-carbohydrazide is C19H17Cl2N5O.
The molecular weight of 3-(2,5-dichlorophenyl)-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-1H-pyrazole-5-carbohydrazide is 401.08102 g/mol.
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