ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride
TL;DR: ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride (CAS 7135-26-4) is a chemical compound with molecular formula C22H27ClN2O4 and molecular weight 418.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(dimethylamino)methyl]-5-hydroxy-1-(4-methoxyphenyl)-2-methylindole-3-carboxylate;hydrochloride
Also Known As: ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride, 4-Dimethylaminomethyl-5-hydroxy-1-(4-methoxy-phenyl)-2-methyl-1H-indole-3-carboxylic acid ethyl ester, ethyl 4-(dimethylaminomethyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methylindole-3-carboxylate hydrochloride
| Molecular Formula | C22H27ClN2O4 |
|---|---|
| Molecular Weight | 418.17 g/mol |
| LogP | 4.31322 |
| Topological Polar Surface Area | 63.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.16592 |
| Heavy Atoms | 29 |
| Complexity | 1010.06445 |
Chemical Identifiers
| CAS Number | 7135-26-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)CN(C)C)C3=CC=C(C=C3)OC)C.Cl |
Product Overview
ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride (CAS 7135-26-4), with molecular formula C22H27ClN2O4 and molecular weight 418.17 g/mol. IUPAC: ethyl 4-[(dimethylamino)methyl]-5-hydroxy-1-(4-methoxyphenyl)-2-methylindole-3-carboxylate;hydrochloride.
Chemical Property Profile of ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride
Property Insights of ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride
The XLogP value of 4.31322 indicates that ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.93 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride. Following Lipinski's Rule of Five, ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride has 1 hydrogen bond donor(s) and 5 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 ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride?
The CAS number of ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride is 7135-26-4.
What is the molecular formula of ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride?
The molecular formula of ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride is C22H27ClN2O4.
What is the molecular weight of ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride?
The molecular weight of ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride is 418.17 g/mol.
Where can I buy ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride?
You can request a quote for ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-((dimethylamino)methyl)-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.