F1110-0326
TL;DR: F1110-0326 (CAS 683258-00-6) is a chemical compound with molecular formula C21H18ClN3O2S and molecular weight 411.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(5-chloro-2-methylanilino)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Also Known As: F1110-0326, (E)-3-((5-chloro-2-methylphenyl)amino)-2-(4-(3,4-dimethoxyphenyl)thiazol-2-yl)acrylonitrile, (2E)-3-[(5-chloro-2-methylphenyl)amino]-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile, (E)-3-(5-chloro-2-methylanilino)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
| Molecular Formula | C21H18ClN3O2S |
|---|---|
| Molecular Weight | 411.08 g/mol |
| LogP | 5.7657 |
| Topological Polar Surface Area | 67.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.0808 |
| Heavy Atoms | 28 |
| Complexity | 1069.7529 |
Chemical Identifiers
| CAS Number | 683258-00-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)Cl)N/C=C(\C#N)/C2=NC(=CS2)C3=CC(=C(C=C3)OC)OC |
Product Overview
F1110-0326 (CAS 683258-00-6), with molecular formula C21H18ClN3O2S and molecular weight 411.08 g/mol. IUPAC: (E)-3-(5-chloro-2-methylanilino)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile.
Chemical Property Profile of F1110-0326
Property Insights of F1110-0326
The XLogP value of 5.7657 indicates that F1110-0326 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.17 Ų falls within the moderate polarity range, balancing permeability and solubility for F1110-0326. Following Lipinski's Rule of Five, F1110-0326 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1110-0326?
The CAS number of F1110-0326 is 683258-00-6.
What is the molecular formula of F1110-0326?
The molecular formula of F1110-0326 is C21H18ClN3O2S.
What is the molecular weight of F1110-0326?
The molecular weight of F1110-0326 is 411.08 g/mol.
Where can I buy F1110-0326?
You can request a quote for F1110-0326 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1110-0326?
Yes, KEHONG BIO provides custom synthesis services for F1110-0326 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.