F0526-2207
TL;DR: F0526-2207 (CAS 476368-09-9) is a chemical compound with molecular formula C21H15N3O5S2 and molecular weight 453.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-3-(5-nitrothiophen-2-yl)prop-2-enamide
Also Known As: F0526-2207, (2E)-N-{5-[(2H-1,3-benzodioxol-5-yl)methyl]-3-cyano-4-methylthiophen-2-yl}-3-(5-nitrothiophen-2-yl)prop-2-enamide, (E)-N-(5-(benzo[d][1,3]dioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl)-3-(5-nitrothiophen-2-yl)acrylamide, (E)-N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-3-(5-nitrothiophen-2-yl)prop-2-enamide, N-{5-[(2H-1,3-benzodioxol-5-yl)methyl]-3-cyano-4-methyl-2-thienyl}-(E)-3-(5-nitro-2-thienyl)acrylamide
| Molecular Formula | C21H15N3O5S2 |
|---|---|
| Molecular Weight | 453.05 g/mol |
| LogP | 4.8693 |
| Topological Polar Surface Area | 114.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 453.04532 |
| Heavy Atoms | 31 |
| Complexity | 1252.4292 |
Chemical Identifiers
| CAS Number | 476368-09-9 |
|---|---|
| SMILES | CC1=C(SC(=C1C#N)NC(=O)/C=C/C2=CC=C(S2)[N+](=O)[O-])CC3=CC4=C(C=C3)OCO4 |
Product Overview
F0526-2207 (CAS 476368-09-9), with molecular formula C21H15N3O5S2 and molecular weight 453.05 g/mol. IUPAC: (E)-N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-3-(5-nitrothiophen-2-yl)prop-2-enamide.
Chemical Property Profile of F0526-2207
Property Insights of F0526-2207
The XLogP value of 4.8693 indicates that F0526-2207 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.49 Ų falls within the moderate polarity range, balancing permeability and solubility for F0526-2207. Following Lipinski's Rule of Five, F0526-2207 has 1 hydrogen bond donor(s) and 8 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 F0526-2207?
The CAS number of F0526-2207 is 476368-09-9.
What is the molecular formula of F0526-2207?
The molecular formula of F0526-2207 is C21H15N3O5S2.
What is the molecular weight of F0526-2207?
The molecular weight of F0526-2207 is 453.05 g/mol.
Where can I buy F0526-2207?
You can request a quote for F0526-2207 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0526-2207?
Yes, KEHONG BIO provides custom synthesis services for F0526-2207 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.