1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride
TL;DR: 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride (CAS 77941-18-5) is a chemical compound with molecular formula C15H21ClN2O3 and molecular weight 312.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-[2-(dimethylamino)ethyl]-3-methoxyindole-2-carboxylate;hydrochloride
Also Known As: 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride, 1-(beta-Dimethylaminoaethyl)-2-methoxycarbonyl-3-methoxy-indol-hydrochlorid [German], 1-(beta-Dimethylaminoaethyl)-2-methoxycarbonyl-3-methoxy-indol-hydrochlorid, 1- -2-methoxycarbonyl-3-methoxy-indol-hydrochlorid[German], Methyl 1-[2-(dimethylamino)ethyl]-3-methoxy-1H-indole-2-carboxylate hydrochloride
| Molecular Formula | C15H21ClN2O3 |
|---|---|
| Molecular Weight | 312.12 g/mol |
| LogP | 2.4199 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.12408 |
| Heavy Atoms | 21 |
| Complexity | 622.6514 |
Chemical Identifiers
| CAS Number | 77941-18-5 |
|---|---|
| SMILES | CN(C)CCN1C2=CC=CC=C2C(=C1C(=O)OC)OC.Cl |
Product Overview
1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride (CAS 77941-18-5), with molecular formula C15H21ClN2O3 and molecular weight 312.12 g/mol. IUPAC: methyl 1-[2-(dimethylamino)ethyl]-3-methoxyindole-2-carboxylate;hydrochloride.
Chemical Property Profile of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride
Property Insights of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride
The XLogP value of 2.4199 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride. With a topological polar surface area (TPSA) of 43.7 Ų, 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride has 0 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 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride?
The CAS number of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride is 77941-18-5.
What is the molecular formula of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride?
The molecular formula of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride is C15H21ClN2O3.
What is the molecular weight of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride?
The molecular weight of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride is 312.12 g/mol.
Where can I buy 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride?
You can request a quote for 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, 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 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-3-methoxy-, methyl ester, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.