F2590-0758
TL;DR: F2590-0758 (CAS 896322-37-5) is a chemical compound with molecular formula C20H17N3O5S and molecular weight 411.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-cyano-5-[[3-(2,5-dioxopyrrolidin-1-yl)benzoyl]amino]-3-methylthiophene-2-carboxylate
Also Known As: F2590-0758, ethyl 4-cyano-5-(3-(2,5-dioxopyrrolidin-1-yl)benzamido)-3-methylthiophene-2-carboxylate, ethyl 4-cyano-5-[[3-(2,5-dioxopyrrolidin-1-yl)benzoyl]amino]-3-methylthiophene-2-carboxylate, ethyl 4-cyano-5-[3-(2,5-dioxopyrrolidin-1-yl)benzamido]-3-methylthiophene-2-carboxylate
| Molecular Formula | C20H17N3O5S |
|---|---|
| Molecular Weight | 411.09 g/mol |
| LogP | 3.0106 |
| Topological Polar Surface Area | 116.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.0889 |
| Heavy Atoms | 29 |
| Complexity | 1050.5543 |
Chemical Identifiers
| CAS Number | 896322-37-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)N3C(=O)CCC3=O)C#N)C |
Product Overview
F2590-0758 (CAS 896322-37-5), with molecular formula C20H17N3O5S and molecular weight 411.09 g/mol. IUPAC: ethyl 4-cyano-5-[[3-(2,5-dioxopyrrolidin-1-yl)benzoyl]amino]-3-methylthiophene-2-carboxylate.
Chemical Property Profile of F2590-0758
Property Insights of F2590-0758
The XLogP value of 3.0106 indicates that F2590-0758 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.57 Ų falls within the moderate polarity range, balancing permeability and solubility for F2590-0758. Following Lipinski's Rule of Five, F2590-0758 has 1 hydrogen bond donor(s) and 7 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 F2590-0758?
The CAS number of F2590-0758 is 896322-37-5.
What is the molecular formula of F2590-0758?
The molecular formula of F2590-0758 is C20H17N3O5S.
What is the molecular weight of F2590-0758?
The molecular weight of F2590-0758 is 411.09 g/mol.
Where can I buy F2590-0758?
You can request a quote for F2590-0758 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2590-0758?
Yes, KEHONG BIO provides custom synthesis services for F2590-0758 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.