Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride
TL;DR: Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride (CAS 73426-20-7) is a chemical compound with molecular formula C15H19ClN2O2S and molecular weight 326.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(methylamino)ethyl]-3,4-dihydro-2H-thiopyrano[2,3-b]indole-9-carboxylic acid;hydrochloride
Also Known As: Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride, 4-[2-(methylamino)ethyl]-3,4-dihydro-2H-thiopyrano[2,3-b]indole-9-carboxylic acid hydrochloride, 4-[2-(Methylamino)ethyl]-3,4-dihydrothiopyrano[2,3-b]indole-9(2H)-carboxylic acid--hydrogen chloride (1/1), RefChem:385354
| Molecular Formula | C15H19ClN2O2S |
|---|---|
| Molecular Weight | 326.09 g/mol |
| LogP | 3.7781 |
| Topological Polar Surface Area | 54.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.08557 |
| Heavy Atoms | 21 |
| Complexity | 656.4062 |
Chemical Identifiers
| CAS Number | 73426-20-7 |
|---|---|
| SMILES | CNCCC1CCSC2=C1C3=CC=CC=C3N2C(=O)O.Cl |
Product Overview
Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride (CAS 73426-20-7), with molecular formula C15H19ClN2O2S and molecular weight 326.09 g/mol. IUPAC: 4-[2-(methylamino)ethyl]-3,4-dihydro-2H-thiopyrano[2,3-b]indole-9-carboxylic acid;hydrochloride.
Chemical Property Profile of Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride
Property Insights of Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride
The XLogP value of 3.7781 indicates that Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.26 Ų, Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride has 2 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 Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride?
The CAS number of Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride is 73426-20-7.
What is the molecular formula of Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride?
The molecular formula of Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride is C15H19ClN2O2S.
What is the molecular weight of Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride?
The molecular weight of Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride is 326.09 g/mol.
Where can I buy Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride?
You can request a quote for Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Thiopyrano(2,3-b)indole-9-carboxylic acid, 2,3,4,9-tetrahydro-4-((methylamino)methyl)-, methyl ester, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.