11R-0603
TL;DR: 11R-0603 (CAS 477858-89-2) is a chemical compound with molecular formula C20H17NO5S2 and molecular weight 415.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(4-methylphenyl)sulfonyl-3-(thiophene-2-carbonylamino)benzoate
Also Known As: 11R-0603, methyl 4-(4-methylphenyl)sulfonyl-3-(thiophene-2-carbonylamino)benzoate, methyl 4-[(4-methylphenyl)sulfonyl]-3-[(2-thienylcarbonyl)amino]benzenecarboxylate, methyl 4-(4-methylbenzenesulfonyl)-3-(thiophene-2-amido)benzoate, methyl4-(4-methylbenzenesulfonyl)-3-(thiophene-2-amido)benzoate
| Molecular Formula | C20H17NO5S2 |
|---|---|
| Molecular Weight | 415.05 g/mol |
| LogP | 3.92822 |
| Topological Polar Surface Area | 89.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 415.0548 |
| Heavy Atoms | 28 |
| Complexity | 1117.9126 |
Chemical Identifiers
| CAS Number | 477858-89-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC=CS3 |
Product Overview
11R-0603 (CAS 477858-89-2), with molecular formula C20H17NO5S2 and molecular weight 415.05 g/mol. IUPAC: methyl 4-(4-methylphenyl)sulfonyl-3-(thiophene-2-carbonylamino)benzoate.
Chemical Property Profile of 11R-0603
Property Insights of 11R-0603
The XLogP value of 3.92822 indicates that 11R-0603 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 11R-0603. Following Lipinski's Rule of Five, 11R-0603 has 1 hydrogen bond donor(s) and 6 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 11R-0603?
The CAS number of 11R-0603 is 477858-89-2.
What is the molecular formula of 11R-0603?
The molecular formula of 11R-0603 is C20H17NO5S2.
What is the molecular weight of 11R-0603?
The molecular weight of 11R-0603 is 415.05 g/mol.
Where can I buy 11R-0603?
You can request a quote for 11R-0603 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11R-0603?
Yes, KEHONG BIO provides custom synthesis services for 11R-0603 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.