N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline
TL;DR: N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline (CAS 374102-55-3) is a chemical compound with molecular formula C17H15NOS and molecular weight 281.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methoxy-1-benzothiophen-2-yl)-N-(3-methylphenyl)methanimine
Also Known As: UPCMLD0ENAT0509-0967:001, (E)-N-((3-methoxybenzo[b]thiophen-2-yl)methylene)-3-methylaniline, 1-(3-methoxy-1-benzothiophen-2-yl)-N-(3-methylphenyl)methanimine, N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline
| Molecular Formula | C17H15NOS |
|---|---|
| Molecular Weight | 281.09 g/mol |
| LogP | 4.96892 |
| Topological Polar Surface Area | 21.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.08743 |
| Heavy Atoms | 20 |
| Complexity | 773.511 |
Chemical Identifiers
| CAS Number | 374102-55-3 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N=CC2=C(C3=CC=CC=C3S2)OC |
Product Overview
N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline (CAS 374102-55-3), with molecular formula C17H15NOS and molecular weight 281.09 g/mol. IUPAC: 1-(3-methoxy-1-benzothiophen-2-yl)-N-(3-methylphenyl)methanimine.
Chemical Property Profile of N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline
Property Insights of N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline
The XLogP value of 4.96892 indicates that N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.59 Ų, N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline?
The CAS number of N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline is 374102-55-3.
What is the molecular formula of N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline?
The molecular formula of N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline is C17H15NOS.
What is the molecular weight of N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline?
The molecular weight of N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline is 281.09 g/mol.
Where can I buy N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline?
You can request a quote for N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[(E)-(3-methoxy-1-benzothiophen-2-yl)methylidene]-3-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.