methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate
TL;DR: methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate (CAS 896593-90-1) is a chemical compound with molecular formula C17H14F2N2O4S and molecular weight 380.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-fluoro-3-[(4-fluoro-3-methylphenyl)sulfonylamino]-1H-indole-2-carboxylate
Also Known As: methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate, methyl 5-fluoro-3-[(4-fluoro-3-methylphenyl)sulfonylamino]-1H-indole-2-carboxylate, methyl 5-fluoro-3-{[(4-fluoro-3-methylphenyl)sulfonyl]amino}-1H-indole-2-carboxylate, 5-Fluoro-3-(4-fluoro-3-methyl-benzenesulfonylamino)-1H-indole-2-carboxylic acid methyl ester
| Molecular Formula | C17H14F2N2O4S |
|---|---|
| Molecular Weight | 380.06 g/mol |
| LogP | 3.34192 |
| Topological Polar Surface Area | 88.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.06424 |
| Heavy Atoms | 26 |
| Complexity | 1123.2384 |
Chemical Identifiers
| CAS Number | 896593-90-1 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)NC2=C(NC3=C2C=C(C=C3)F)C(=O)OC)F |
Product Overview
methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate (CAS 896593-90-1), with molecular formula C17H14F2N2O4S and molecular weight 380.06 g/mol. IUPAC: methyl 5-fluoro-3-[(4-fluoro-3-methylphenyl)sulfonylamino]-1H-indole-2-carboxylate.
Chemical Property Profile of methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate
Property Insights of methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate
The XLogP value of 3.34192 indicates that methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.26 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate has 2 hydrogen bond donor(s) and 4 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 methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate?
The CAS number of methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate is 896593-90-1.
What is the molecular formula of methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate?
The molecular formula of methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate is C17H14F2N2O4S.
What is the molecular weight of methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate?
The molecular weight of methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate is 380.06 g/mol.
Where can I buy methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate?
You can request a quote for methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-fluoro-3-(4-fluoro-3-methylphenylsulfonamido)-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.