![3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide structure](/static/products/444/444909-26-6.png)
3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide
TL;DR: 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide (CAS 444909-26-6) is a chemical compound with molecular formula C18H12ClF3N2OS and molecular weight 396.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-6-methyl-N-[(E)-[4-(trifluoromethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide
Also Known As: 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide, 3-chloro-6-methyl-N-[(E)-[4-(trifluoromethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide, 3-chloro-6-methyl-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}-1-benzothiophene-2-carbohydrazide, 3-CHLORO-6-METHYL-N'-{(E)-1-[4-(TRIFLUOROMETHYL)PHENYL]METHYLIDENE}-1-BENZOTHIOPHENE-2-CARBOHYDRAZIDE
| Molecular Formula | C18H12ClF3N2OS |
|---|---|
| Molecular Weight | 396.03 g/mol |
| LogP | 5.64582 |
| Topological Polar Surface Area | 41.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 396.0311 |
| Heavy Atoms | 26 |
| Complexity | 994.0791 |
Chemical Identifiers
| CAS Number | 444909-26-6 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C(=C(S2)C(=O)N/N=C/C3=CC=C(C=C3)C(F)(F)F)Cl |
Product Overview
3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide (CAS 444909-26-6), with molecular formula C18H12ClF3N2OS and molecular weight 396.03 g/mol. IUPAC: 3-chloro-6-methyl-N-[(E)-[4-(trifluoromethyl)phenyl]methylideneamino]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide
Property Insights of 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide
The XLogP value of 5.64582 indicates that 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-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 41.46 Ų, 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide has 1 hydrogen bond donor(s) and 3 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-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide?
The CAS number of 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide is 444909-26-6.
What is the molecular formula of 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide?
The molecular formula of 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide is C18H12ClF3N2OS.
What is the molecular weight of 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide?
The molecular weight of 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide is 396.03 g/mol.
Where can I buy 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide?
You can request a quote for 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-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-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-6-methyl-N'-[4-(trifluoromethyl)benzylidene]-1-benzothiophene-2-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.