![2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate structure](/static/products/374/374547-37-2.png)
2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate
TL;DR: 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate (CAS 374547-37-2) is a chemical compound with molecular formula C17H12ClNO2S and molecular weight 329.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(3-chloro-1-benzothiophen-2-yl)methylideneamino]phenyl] acetate
Also Known As: [2-[(3-chloro-1-benzothiophen-2-yl)methylideneamino]phenyl] acetate, (E)-2-(((3-chlorobenzo[b]thiophen-2-yl)methylene)amino)phenyl acetate, 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate
| Molecular Formula | C17H12ClNO2S |
|---|---|
| Molecular Weight | 329.03 g/mol |
| LogP | 5.2306 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.02774 |
| Heavy Atoms | 22 |
| Complexity | 869.9764 |
Chemical Identifiers
| CAS Number | 374547-37-2 |
|---|---|
| SMILES | CC(=O)OC1=CC=CC=C1N=CC2=C(C3=CC=CC=C3S2)Cl |
Product Overview
2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate (CAS 374547-37-2), with molecular formula C17H12ClNO2S and molecular weight 329.03 g/mol. IUPAC: [2-[(3-chloro-1-benzothiophen-2-yl)methylideneamino]phenyl] acetate.
Chemical Property Profile of 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate
Property Insights of 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate
The XLogP value of 5.2306 indicates that 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.66 Ų, 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate has 0 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 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate?
The CAS number of 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate is 374547-37-2.
What is the molecular formula of 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate?
The molecular formula of 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate is C17H12ClNO2S.
What is the molecular weight of 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate?
The molecular weight of 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate is 329.03 g/mol.
Where can I buy 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate?
You can request a quote for 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]amino}phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.