![Naphtho[1,2-b][1]benzothiole-6-carbonitrile structure](/static/products/898/89817-27-6.png)
Naphtho[1,2-b][1]benzothiole-6-carbonitrile
TL;DR: Naphtho[1,2-b][1]benzothiole-6-carbonitrile (CAS 89817-27-6) is a chemical compound with molecular formula C17H9NS and molecular weight 259.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphtho[1,2-b][1]benzothiole-6-carbonitrile
Also Known As: naphtho[1,2-b][1]benzothiole-6-carbonitrile, naphtho[1,2-b][1]benzothiophene-6-carbonitrile, naphtho[1,2-b]benzo[b]thiophene-6-carbonitrile, AM-944/40947649
| Molecular Formula | C17H9NS |
|---|---|
| Molecular Weight | 259.05 g/mol |
| LogP | 5.07938 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 259.04556 |
| Heavy Atoms | 19 |
| Complexity | 972.97375 |
Chemical Identifiers
| CAS Number | 89817-27-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C3=C2SC4=CC=CC=C43)C#N |
Product Overview
Naphtho[1,2-b][1]benzothiole-6-carbonitrile (CAS 89817-27-6), with molecular formula C17H9NS and molecular weight 259.05 g/mol. IUPAC: naphtho[1,2-b][1]benzothiole-6-carbonitrile.
Chemical Property Profile of Naphtho[1,2-b][1]benzothiole-6-carbonitrile
Property Insights of Naphtho[1,2-b][1]benzothiole-6-carbonitrile
The XLogP value of 5.07938 indicates that Naphtho[1,2-b][1]benzothiole-6-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.79 Ų, Naphtho[1,2-b][1]benzothiole-6-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphtho[1,2-b][1]benzothiole-6-carbonitrile 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 Naphtho[1,2-b][1]benzothiole-6-carbonitrile?
The CAS number of Naphtho[1,2-b][1]benzothiole-6-carbonitrile is 89817-27-6.
What is the molecular formula of Naphtho[1,2-b][1]benzothiole-6-carbonitrile?
The molecular formula of Naphtho[1,2-b][1]benzothiole-6-carbonitrile is C17H9NS.
What is the molecular weight of Naphtho[1,2-b][1]benzothiole-6-carbonitrile?
The molecular weight of Naphtho[1,2-b][1]benzothiole-6-carbonitrile is 259.05 g/mol.
Where can I buy Naphtho[1,2-b][1]benzothiole-6-carbonitrile?
You can request a quote for Naphtho[1,2-b][1]benzothiole-6-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphtho[1,2-b][1]benzothiole-6-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for Naphtho[1,2-b][1]benzothiole-6-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.