![5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline structure](/static/products/5923/59237-12-6.webp)
5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline
TL;DR: 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline (CAS 59237-12-6) is a chemical compound with molecular formula C17H13NS and molecular weight 263.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-[1]benzothiolo[3,2-h]isoquinoline
Also Known As: 5-ethyl-[1]benzothiolo[3,2-h]isoquinoline, 5-Ethyl[1]benzothieno[3,2-h]isoquinoline
| Molecular Formula | C17H13NS |
|---|---|
| Molecular Weight | 263.08 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.07687 |
| Heavy Atoms | 19 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 59237-12-6 |
|---|---|
| SMILES | CCC1=CC2=C(C3=C1C=CN=C3)SC4=CC=CC=C42 |
| InChIKey | KJYPIBKWSJCSBR-UHFFFAOYSA-N |
Product Overview
5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline (CAS 59237-12-6), with molecular formula C17H13NS and molecular weight 263.08 g/mol. IUPAC: 5-ethyl-[1]benzothiolo[3,2-h]isoquinoline.
Chemical Property Profile of 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline
Property Insights of 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline
The XLogP value of 5.3 indicates that 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline?
The CAS number of 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline is 59237-12-6.
What is the molecular formula of 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline?
The molecular formula of 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline is C17H13NS.
What is the molecular weight of 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline?
The molecular weight of 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline is 263.08 g/mol.
Where can I buy 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline?
You can request a quote for 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-[1]benzothiolo[3,2-h]isoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.