3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide
TL;DR: 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide (CAS 1344733-84-1) is a chemical compound with molecular formula C20H14Cl2N4OS and molecular weight 428.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-1-benzothiophene-2-carboxamide
Also Known As: 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide, (E)-3-chloro-N'-((5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)benzo[b]thiophene-2-carbohydrazide, 3-chloro-N-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]benzothiophene-2-carboxamide, 3-chloro-N-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-1-benzothiophene-2-carboxamide, N-[(1E)-2-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-1-azavinyl](3-chlorobenzo[b ]thiophen-2-yl)carboxamide
| Molecular Formula | C20H14Cl2N4OS |
|---|---|
| Molecular Weight | 428.03 g/mol |
| LogP | 5.46612 |
| Topological Polar Surface Area | 59.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.02655 |
| Heavy Atoms | 28 |
| Complexity | 1197.8702 |
Chemical Identifiers
| CAS Number | 1344733-84-1 |
|---|---|
| SMILES | CC1=NN(C(=C1/C=N/NC(=O)C2=C(C3=CC=CC=C3S2)Cl)Cl)C4=CC=CC=C4 |
Product Overview
3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide (CAS 1344733-84-1), with molecular formula C20H14Cl2N4OS and molecular weight 428.03 g/mol. IUPAC: 3-chloro-N-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide
Property Insights of 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide
The XLogP value of 5.46612 indicates that 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.28 Ų, 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide?
The CAS number of 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide is 1344733-84-1.
What is the molecular formula of 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide?
The molecular formula of 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide is C20H14Cl2N4OS.
What is the molecular weight of 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide?
The molecular weight of 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide is 428.03 g/mol.
Where can I buy 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide?
You can request a quote for 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-1-benzothiophene-2-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.