F1736-1942
TL;DR: F1736-1942 (CAS 868154-58-9) is a chemical compound with molecular formula C22H22N2O4S and molecular weight 410.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[(E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: F1736-1942, ethyl 2-[(2E)-2-cyano-3-(3-methoxyphenyl)prop-2-enamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, (E)-ethyl 2-(2-cyano-3-(3-methoxyphenyl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-[[(E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C22H22N2O4S |
|---|---|
| Molecular Weight | 410.13 g/mol |
| LogP | 4.35788 |
| Topological Polar Surface Area | 88.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.13004 |
| Heavy Atoms | 29 |
| Complexity | 1000.72656 |
Chemical Identifiers
| CAS Number | 868154-58-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)/C(=C/C3=CC(=CC=C3)OC)/C#N |
Product Overview
F1736-1942 (CAS 868154-58-9), with molecular formula C22H22N2O4S and molecular weight 410.13 g/mol. IUPAC: ethyl 2-[[(E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of F1736-1942
Property Insights of F1736-1942
The XLogP value of 4.35788 indicates that F1736-1942 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.42 Ų falls within the moderate polarity range, balancing permeability and solubility for F1736-1942. Following Lipinski's Rule of Five, F1736-1942 has 1 hydrogen bond donor(s) and 6 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 F1736-1942?
The CAS number of F1736-1942 is 868154-58-9.
What is the molecular formula of F1736-1942?
The molecular formula of F1736-1942 is C22H22N2O4S.
What is the molecular weight of F1736-1942?
The molecular weight of F1736-1942 is 410.13 g/mol.
Where can I buy F1736-1942?
You can request a quote for F1736-1942 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1736-1942?
Yes, KEHONG BIO provides custom synthesis services for F1736-1942 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.