F0737-0461
TL;DR: F0737-0461 (CAS 394228-27-4) is a chemical compound with molecular formula C26H18N6O2S and molecular weight 478.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-[2-cyano-1-hydroxy-2-(1-methylbenzimidazol-2-yl)ethenyl]thiophen-2-yl]-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile
Also Known As: F0737-0461, (E)-3-{5-[(E)-2-cyano-2-(1-methyl-1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)acetyl]-2-thienyl}-2-(1-methyl-1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)-3-oxopropiononitrile, 3-(5-{2-cyano-2-[(2E)-1-methyl-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]acetyl}thiophen-2-yl)-2-[(2E)-1-methyl-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]-3-oxopropanenitrile
| Molecular Formula | C26H18N6O2S |
|---|---|
| Molecular Weight | 478.12 g/mol |
| LogP | 5.42126 |
| Topological Polar Surface Area | 123.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 478.1212 |
| Heavy Atoms | 35 |
| Complexity | 1642.2946 |
Chemical Identifiers
| CAS Number | 394228-27-4 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N=C1C(=C(C3=CC=C(S3)C(=C(C#N)C4=NC5=CC=CC=C5N4C)O)O)C#N |
Product Overview
F0737-0461 (CAS 394228-27-4), with molecular formula C26H18N6O2S and molecular weight 478.12 g/mol. IUPAC: 3-[5-[2-cyano-1-hydroxy-2-(1-methylbenzimidazol-2-yl)ethenyl]thiophen-2-yl]-3-hydroxy-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile.
Chemical Property Profile of F0737-0461
Property Insights of F0737-0461
The XLogP value of 5.42126 indicates that F0737-0461 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.68 Ų falls within the moderate polarity range, balancing permeability and solubility for F0737-0461. Following Lipinski's Rule of Five, F0737-0461 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0737-0461?
The CAS number of F0737-0461 is 394228-27-4.
What is the molecular formula of F0737-0461?
The molecular formula of F0737-0461 is C26H18N6O2S.
What is the molecular weight of F0737-0461?
The molecular weight of F0737-0461 is 478.12 g/mol.
Where can I buy F0737-0461?
You can request a quote for F0737-0461 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0737-0461?
Yes, KEHONG BIO provides custom synthesis services for F0737-0461 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.