RefChem:349316
TL;DR: RefChem:349316 (CAS 16200-04-7) is a chemical compound with molecular formula C24H31ClN2O3 and molecular weight 430.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(diethylaminomethyl)-5-hydroxy-2-methyl-1-(4-methylphenyl)indole-3-carboxylate;hydrochloride
Also Known As: Indole-3-carboxylic acid, 4-((diethylamino)methyl)-5-hydroxy-2-methyl-1-p-tolyl-, ethyl ester, monohydrochloride, 4-((Diethylamino)methyl)-5-hydroxy-2-methyl-1-p-tolylindole-3-carboxylic acid ethyl ester HCl, ethyl 4-(diethylaminomethyl)-5-hydroxy-2-methyl-1-(4-methylphenyl)indole-3-carboxylate hydrochloride, Ethyl 4-[(diethylamino)methyl]-5-hydroxy-2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate--hydrogen chloride (1/1), RefChem:349316
| Molecular Formula | C24H31ClN2O3 |
|---|---|
| Molecular Weight | 430.20 g/mol |
| LogP | 5.39324 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 430.20233 |
| Heavy Atoms | 30 |
| Complexity | 530.0 |
Chemical Identifiers
| CAS Number | 16200-04-7 |
|---|---|
| SMILES | CCN(CC)CC1=C(C=CC2=C1C(=C(N2C3=CC=C(C=C3)C)C)C(=O)OCC)O.Cl |
| InChIKey | OZXYTOKUIBIUAM-UHFFFAOYSA-N |
Product Overview
RefChem:349316 (CAS 16200-04-7), with molecular formula C24H31ClN2O3 and molecular weight 430.20 g/mol. IUPAC: ethyl 4-(diethylaminomethyl)-5-hydroxy-2-methyl-1-(4-methylphenyl)indole-3-carboxylate;hydrochloride.
Chemical Property Profile of RefChem:349316
Property Insights of RefChem:349316
The XLogP value of 5.39324 indicates that RefChem:349316 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.7 Ų, RefChem:349316 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:349316 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:349316?
The CAS number of RefChem:349316 is 16200-04-7.
What is the molecular formula of RefChem:349316?
The molecular formula of RefChem:349316 is C24H31ClN2O3.
What is the molecular weight of RefChem:349316?
The molecular weight of RefChem:349316 is 430.20 g/mol.
Where can I buy RefChem:349316?
You can request a quote for RefChem:349316 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:349316?
Yes, KEHONG BIO provides custom synthesis services for RefChem:349316 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.