TL;DR: (E)-N'-(4-methoxy-3-((pyridin-2-ylthio)methyl)benzylidene)-1H-pyrazole-3-carbohydrazide (CAS 304652-78-6) is a chemical compound with molecular formula C18H17N5O2S and molecular weight 367.1103 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]methylideneamino]-1H-pyrazole-5-carboxamide
Also Known As: (E)-N'-(4-methoxy-3-((pyridin-2-ylthio)methyl)benzylidene)-1H-pyrazole-3-carbohydrazide, N'-[(E)-{4-methoxy-3-[(pyridin-2-ylsulfanyl)methyl]phenyl}methylidene]-1H-pyrazole-3-carbohydrazide
| Molecular Formula | C18H17N5O2S |
| Molecular Weight | 367.1103 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 367.1103 Da |
| Heavy Atoms | 26 |
| Complexity | 478.0 |
| SMILES | COC1=C(C=C(C=C1)/C=N/NC(=O)C2=CC=NN2)CSC3=CC=CC=N3 |
| InChIKey | MZUWLSVORLNYBL-SRZZPIQSSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N'-(4-methoxy-3-((pyridin-2-ylthio)methyl)benzylidene)-1H-pyrazole-3-carbohydrazide. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-(4-methoxy-3-((pyridin-2-ylthio)methyl)benzylidene)-1H-pyrazole-3-carbohydrazide. Following Lipinski's Rule of Five, (E)-N'-(4-methoxy-3-((pyridin-2-ylthio)methyl)benzylidene)-1H-pyrazole-3-carbohydrazide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (E)-N'-(4-methoxy-3-((pyridin-2-ylthio)methyl)benzylidene)-1H-pyrazole-3-carbohydrazide is 304652-78-6.
The molecular formula of (E)-N'-(4-methoxy-3-((pyridin-2-ylthio)methyl)benzylidene)-1H-pyrazole-3-carbohydrazide is C18H17N5O2S.
The molecular weight of (E)-N'-(4-methoxy-3-((pyridin-2-ylthio)methyl)benzylidene)-1H-pyrazole-3-carbohydrazide is 367.1103 g/mol.
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