![methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate structure](/static/products/899/899408-48-1.png)
methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate
TL;DR: methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate (CAS 899408-48-1) is a chemical compound with molecular formula C17H15FN2O4S and molecular weight 362.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(benzylsulfonylamino)-5-fluoro-1H-indole-2-carboxylate
Also Known As: methyl 3-(benzylsulfonylamino)-5-fluoro-1H-indole-2-carboxylate, methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate, methyl 5-fluoro-3-(phenylmethylsulfonamido)-1H-indole-2-carboxylate
| Molecular Formula | C17H15FN2O4S |
|---|---|
| Molecular Weight | 362.07 g/mol |
| LogP | 3.0355 |
| Topological Polar Surface Area | 88.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.07367 |
| Heavy Atoms | 25 |
| Complexity | 1029.4874 |
Chemical Identifiers
| CAS Number | 899408-48-1 |
|---|---|
| SMILES | COC(=O)C1=C(C2=C(N1)C=CC(=C2)F)NS(=O)(=O)CC3=CC=CC=C3 |
Product Overview
methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate (CAS 899408-48-1), with molecular formula C17H15FN2O4S and molecular weight 362.07 g/mol. IUPAC: methyl 3-(benzylsulfonylamino)-5-fluoro-1H-indole-2-carboxylate.
Chemical Property Profile of methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate
Property Insights of methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate
The XLogP value of 3.0355 indicates that methyl 3-[(benzylsulfonyl)amino]-5-fluoro-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 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, methyl 3-[(benzylsulfonyl)amino]-5-fluoro-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 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate?
The CAS number of methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate is 899408-48-1.
What is the molecular formula of methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate?
The molecular formula of methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate is C17H15FN2O4S.
What is the molecular weight of methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate?
The molecular weight of methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate is 362.07 g/mol.
Where can I buy methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate?
You can request a quote for methyl 3-[(benzylsulfonyl)amino]-5-fluoro-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 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-[(benzylsulfonyl)amino]-5-fluoro-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.