F1439-0040
TL;DR: F1439-0040 (CAS 690246-50-5) is a chemical compound with molecular formula C22H27ClN2O8S2 and molecular weight 546.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 5-[[5-[2-chloroethyl(methyl)sulfamoyl]-2-methoxybenzoyl]amino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: F1439-0040, 2,4-DIETHYL 5-{5-[(2-CHLOROETHYL)(METHYL)SULFAMOYL]-2-METHOXYBENZAMIDO}-3-METHYLTHIOPHENE-2,4-DICARBOXYLATE, diethyl 5-[({5-[(2-chloroethyl)(methyl)sulfamoyl]-2-methoxyphenyl}carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate, diethyl 5-[[5-[2-chloroethyl(methyl)sulfamoyl]-2-methoxybenzoyl]amino]-3-methylthiophene-2,4-dicarboxylate, [(2-chloroethyl)-N-methylamino]-4-methoxy-3-(N-3,5-diethoxycarbonyl-4-methyl-2-thienylcarbamoyl)phenyl(oxo)-lambda-sulfaniumolate
| Molecular Formula | C22H27ClN2O8S2 |
|---|---|
| Molecular Weight | 546.09 g/mol |
| LogP | 3.53012 |
| Topological Polar Surface Area | 128.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 546.0897 |
| Heavy Atoms | 35 |
| Complexity | 1210.2782 |
Chemical Identifiers
| CAS Number | 690246-50-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)CCCl)OC |
Product Overview
F1439-0040 (CAS 690246-50-5), with molecular formula C22H27ClN2O8S2 and molecular weight 546.09 g/mol. IUPAC: diethyl 5-[[5-[2-chloroethyl(methyl)sulfamoyl]-2-methoxybenzoyl]amino]-3-methylthiophene-2,4-dicarboxylate.
Chemical Property Profile of F1439-0040
Property Insights of F1439-0040
The XLogP value of 3.53012 indicates that F1439-0040 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.31 Ų falls within the moderate polarity range, balancing permeability and solubility for F1439-0040. Following Lipinski's Rule of Five, F1439-0040 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1439-0040?
The CAS number of F1439-0040 is 690246-50-5.
What is the molecular formula of F1439-0040?
The molecular formula of F1439-0040 is C22H27ClN2O8S2.
What is the molecular weight of F1439-0040?
The molecular weight of F1439-0040 is 546.09 g/mol.
Where can I buy F1439-0040?
You can request a quote for F1439-0040 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1439-0040?
Yes, KEHONG BIO provides custom synthesis services for F1439-0040 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.