F0526-2106
TL;DR: F0526-2106 (CAS 476367-00-7) is a chemical compound with molecular formula C21H20N2O7S and molecular weight 444.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(2,5-dioxopyrrolidin-1-yl)acetyl]amino]-4-methylthiophene-3-carboxylate
Also Known As: F0526-2106, methyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(2,5-dioxopyrrolidin-1-yl)acetyl]amino]-4-methylthiophene-3-carboxylate, methyl 5-(benzo[d][1,3]dioxol-5-ylmethyl)-2-(2-(2,5-dioxopyrrolidin-1-yl)acetamido)-4-methylthiophene-3-carboxylate, methyl 5-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-(2,5-dioxopyrrolidin-1-yl)acetamido]-4-methylthiophene-3-carboxylate
| Molecular Formula | C21H20N2O7S |
|---|---|
| Molecular Weight | 444.10 g/mol |
| LogP | 2.25012 |
| Topological Polar Surface Area | 111.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.09912 |
| Heavy Atoms | 31 |
| Complexity | 1075.6377 |
Chemical Identifiers
| CAS Number | 476367-00-7 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)CN2C(=O)CCC2=O)CC3=CC4=C(C=C3)OCO4 |
Product Overview
F0526-2106 (CAS 476367-00-7), with molecular formula C21H20N2O7S and molecular weight 444.10 g/mol. IUPAC: methyl 5-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(2,5-dioxopyrrolidin-1-yl)acetyl]amino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of F0526-2106
Property Insights of F0526-2106
The XLogP value of 2.25012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0526-2106. The TPSA of 111.24 Ų falls within the moderate polarity range, balancing permeability and solubility for F0526-2106. Following Lipinski's Rule of Five, F0526-2106 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 F0526-2106?
The CAS number of F0526-2106 is 476367-00-7.
What is the molecular formula of F0526-2106?
The molecular formula of F0526-2106 is C21H20N2O7S.
What is the molecular weight of F0526-2106?
The molecular weight of F0526-2106 is 444.10 g/mol.
Where can I buy F0526-2106?
You can request a quote for F0526-2106 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0526-2106?
Yes, KEHONG BIO provides custom synthesis services for F0526-2106 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.