F2646-0100
TL;DR: F2646-0100 (CAS 898422-80-5) is a chemical compound with molecular formula C19H20N2OS2 and molecular weight 356.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-ethylsulfanylbenzamide
Also Known As: F2646-0100, N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(ethylthio)benzamide, N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-ethylsulfanylbenzamide, N-{3-cyano-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl}-2-(ethylsulfanyl)benzamide
| Molecular Formula | C19H20N2OS2 |
|---|---|
| Molecular Weight | 356.10 g/mol |
| LogP | 5.25298 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.1017 |
| Heavy Atoms | 24 |
| Complexity | 789.14984 |
Chemical Identifiers
| CAS Number | 898422-80-5 |
|---|---|
| SMILES | CCSC1=CC=CC=C1C(=O)NC2=C(C3=C(S2)CCCCC3)C#N |
Product Overview
F2646-0100 (CAS 898422-80-5), with molecular formula C19H20N2OS2 and molecular weight 356.10 g/mol. IUPAC: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-ethylsulfanylbenzamide.
Chemical Property Profile of F2646-0100
Property Insights of F2646-0100
The XLogP value of 5.25298 indicates that F2646-0100 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, F2646-0100 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F2646-0100 has 1 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 F2646-0100?
The CAS number of F2646-0100 is 898422-80-5.
What is the molecular formula of F2646-0100?
The molecular formula of F2646-0100 is C19H20N2OS2.
What is the molecular weight of F2646-0100?
The molecular weight of F2646-0100 is 356.10 g/mol.
Where can I buy F2646-0100?
You can request a quote for F2646-0100 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2646-0100?
Yes, KEHONG BIO provides custom synthesis services for F2646-0100 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.