RefChem:438383
TL;DR: RefChem:438383 (CAS 68630-93-3) is a chemical compound with molecular formula C20H36N2O5 and molecular weight 384.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[2-heptyl-3-[2-(3-methoxy-3-oxopropoxy)ethyl]-2H-imidazol-1-yl]propanoate
Also Known As: Methyl 2-heptyl-2,3-dihydro-3-(2-(3-methoxy-3-oxopropoxy)ethyl)-1H-imidazole-1-propionate, 1-(Carboxyethoxyethyl)-3-carboxymethyl-2-heptylimidazoline dimethyl ester, Dimethyl 1-carboxyethoxyethyl-3-carboxymethyl-2-heptylimidazoline, methyl2-heptyl-2,3-dihydro-3-[2- ethyl]-1H-imidazole-1-propionate, 1H-Imidazole-1-propanoic acid, 2-heptyl-2,3-dihydro-3-(2-(3-methoxy-3-oxopropoxy)ethyl)-, methyl ester
| Molecular Formula | C20H36N2O5 |
|---|---|
| Molecular Weight | 384.26 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 17 |
| Exact Mass | 384.26242 |
| Heavy Atoms | 27 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 68630-93-3 |
|---|---|
| SMILES | CCCCCCCC1N(C=CN1CCOCCC(=O)OC)CCC(=O)OC |
| InChIKey | QRPOISBXIZMALK-UHFFFAOYSA-N |
Product Overview
RefChem:438383 (CAS 68630-93-3), with molecular formula C20H36N2O5 and molecular weight 384.26 g/mol. IUPAC: methyl 3-[2-heptyl-3-[2-(3-methoxy-3-oxopropoxy)ethyl]-2H-imidazol-1-yl]propanoate.
Chemical Property Profile of RefChem:438383
Property Insights of RefChem:438383
The XLogP value of 3.6 indicates that RefChem:438383 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:438383. Following Lipinski's Rule of Five, RefChem:438383 has 0 hydrogen bond donor(s) and 7 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 RefChem:438383?
The CAS number of RefChem:438383 is 68630-93-3.
What is the molecular formula of RefChem:438383?
The molecular formula of RefChem:438383 is C20H36N2O5.
What is the molecular weight of RefChem:438383?
The molecular weight of RefChem:438383 is 384.26 g/mol.
Where can I buy RefChem:438383?
You can request a quote for RefChem:438383 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:438383?
Yes, KEHONG BIO provides custom synthesis services for RefChem:438383 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.