3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide
TL;DR: 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide (CAS 444930-65-8) is a chemical compound with molecular formula C17H15ClN2OS2 and molecular weight 362.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide
Also Known As: 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide, 3-chloro-6-ethyl-N'-[(5-methyl-2-thienyl)methylene]-1-benzothiophene-2-carbohydrazide, 3-chloro-6-ethyl-N'-[(E)-(5-methylthiophen-2-yl)methylidene]-1-benzothiophene-2-carbohydrazide, N-[(1E)-2-(5-methyl(2-thienyl))-1-azavinyl](3-chloro-6-ethylbenzo[b]thiophen-2 -yl)carboxamide
| Molecular Formula | C17H15ClN2OS2 |
|---|---|
| Molecular Weight | 362.03 g/mol |
| LogP | 5.25092 |
| Topological Polar Surface Area | 41.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.03143 |
| Heavy Atoms | 23 |
| Complexity | 895.2707 |
Chemical Identifiers
| CAS Number | 444930-65-8 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1)C(=C(S2)C(=O)N/N=C/C3=CC=C(S3)C)Cl |
Product Overview
3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide (CAS 444930-65-8), with molecular formula C17H15ClN2OS2 and molecular weight 362.03 g/mol. IUPAC: 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide
Property Insights of 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide
The XLogP value of 5.25092 indicates that 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide 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-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide 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-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide?
The CAS number of 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide is 444930-65-8.
What is the molecular formula of 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide?
The molecular formula of 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide is C17H15ClN2OS2.
What is the molecular weight of 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide?
The molecular weight of 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide is 362.03 g/mol.
Where can I buy 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide?
You can request a quote for 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide 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-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-6-ethyl-N-[(E)-(5-methylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.