1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride
TL;DR: 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride (CAS 77941-19-6) is a chemical compound with molecular formula C18H27ClN2O3 and molecular weight 354.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-[2-(dimethylamino)ethyl]-5-methyl-3-propan-2-yloxyindole-2-carboxylate;hydrochloride
Also Known As: 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride, 1-(beta-Dimethylaminoaethyl)-2-methoxycarbonyl-3-isopropyloxy-5-methyl-indol-hydrochlorid, methyl 1-(2-dimethylaminoethyl)-5-methyl-3-propan-2-yloxyindole-2-carboxylate hydrochloride, Methyl 1-[2-(dimethylamino)ethyl]-5-methyl-3-[(propan-2-yl)oxy]-1H-indole-2-carboxylate--hydrogen chloride (1/1), methyl 1-[2-(dimethylamino)ethyl]-5-methyl-3-propan-2-yloxyindole-2-carboxylate,hydrochloride
| Molecular Formula | C18H27ClN2O3 |
|---|---|
| Molecular Weight | 354.17 g/mol |
| LogP | 3.50692 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 354.17102 |
| Heavy Atoms | 24 |
| Complexity | 707.84204 |
Chemical Identifiers
| CAS Number | 77941-19-6 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C(=C2OC(C)C)C(=O)OC)CCN(C)C.Cl |
Product Overview
1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride (CAS 77941-19-6), with molecular formula C18H27ClN2O3 and molecular weight 354.17 g/mol. IUPAC: methyl 1-[2-(dimethylamino)ethyl]-5-methyl-3-propan-2-yloxyindole-2-carboxylate;hydrochloride.
Chemical Property Profile of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride
Property Insights of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride
The XLogP value of 3.50692 indicates that 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.7 Ų, 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride 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)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride 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)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride?
The CAS number of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride is 77941-19-6.
What is the molecular formula of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride?
The molecular formula of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride is C18H27ClN2O3.
What is the molecular weight of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride?
The molecular weight of 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride is 354.17 g/mol.
Where can I buy 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride?
You can request a quote for 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride 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)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole-2-carboxylic acid, 1-(2-(dimethylamino)ethyl)-5-methyl-3-(1-methylethoxy)-, methyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.