Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate
TL;DR: Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate (CAS 3835-62-9) is a chemical compound with molecular formula C11H12N2O3S and molecular weight 252.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-methyl-3-sulfinamoylindole-2-carboxylate
Also Known As: 1-methyl-3-sulfinamoyl-indole-2-carboxylic acid methyl ester
| Molecular Formula | C11H12N2O3S |
|---|---|
| Molecular Weight | 252.06 g/mol |
| LogP | 0.9462 |
| Topological Polar Surface Area | 74.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.05687 |
| Heavy Atoms | 17 |
| Complexity | 618.4492 |
Chemical Identifiers
| CAS Number | 3835-62-9 |
|---|---|
| SMILES | CN1C2=CC=CC=C2C(=C1C(=O)OC)S(=O)N |
Product Overview
Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate (CAS 3835-62-9), with molecular formula C11H12N2O3S and molecular weight 252.06 g/mol. IUPAC: methyl 1-methyl-3-sulfinamoylindole-2-carboxylate.
Chemical Property Profile of Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate
Property Insights of Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate
The XLogP value of 0.9462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate. The TPSA of 74.32 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate. Following Lipinski's Rule of Five, Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate has 1 hydrogen bond donor(s) and 3 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 1-methyl-3-sulfinamoylindole-2-carboxylate?
The CAS number of Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate is 3835-62-9.
What is the molecular formula of Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate?
The molecular formula of Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate is C11H12N2O3S.
What is the molecular weight of Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate?
The molecular weight of Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate is 252.06 g/mol.
Where can I buy Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate?
You can request a quote for Methyl 1-methyl-3-sulfinamoylindole-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 1-methyl-3-sulfinamoylindole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 1-methyl-3-sulfinamoylindole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.