C17H15ClN2S
TL;DR: C17H15ClN2S (CAS 406196-47-2) is a chemical compound with molecular formula C17H15ClN2S and molecular weight 314.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-chloro-1-benzothiophen-2-yl)methylideneamino]-N,N-dimethylaniline
Also Known As: AB00713317-01, 4-[(3-chloro-1-benzothiophen-2-yl)methylideneamino]-N,N-dimethylaniline, (E)-N1-((3-chlorobenzo[b]thiophen-2-yl)methylene)-N4,N4-dimethylbenzene-1,4-diamine, N'-[(E)-(3-chloro-1-benzothiophen-2-yl)methylidene]-N,N-dimethylbenzene-1,4-diamine
| Molecular Formula | C17H15ClN2S |
|---|---|
| Molecular Weight | 314.06 g/mol |
| LogP | 5.3713 |
| Topological Polar Surface Area | 15.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.06445 |
| Heavy Atoms | 21 |
| Complexity | 788.1603 |
Chemical Identifiers
| CAS Number | 406196-47-2 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)N=CC2=C(C3=CC=CC=C3S2)Cl |
Product Overview
C17H15ClN2S (CAS 406196-47-2), with molecular formula C17H15ClN2S and molecular weight 314.06 g/mol. IUPAC: 4-[(3-chloro-1-benzothiophen-2-yl)methylideneamino]-N,N-dimethylaniline.
Chemical Property Profile of C17H15ClN2S
Property Insights of C17H15ClN2S
The XLogP value of 5.3713 indicates that C17H15ClN2S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.6 Ų, C17H15ClN2S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C17H15ClN2S has 0 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 C17H15ClN2S?
The CAS number of C17H15ClN2S is 406196-47-2.
What is the molecular formula of C17H15ClN2S?
The molecular formula of C17H15ClN2S is C17H15ClN2S.
What is the molecular weight of C17H15ClN2S?
The molecular weight of C17H15ClN2S is 314.06 g/mol.
Where can I buy C17H15ClN2S?
You can request a quote for C17H15ClN2S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C17H15ClN2S?
Yes, KEHONG BIO provides custom synthesis services for C17H15ClN2S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.