RefChem:351827
TL;DR: RefChem:351827 (CAS 57846-34-1) is a chemical compound with molecular formula C26H26ClNO7 and molecular weight 499.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]propanedioate
Also Known As: 2,5-dibromo-3-dibromomethylthiophene, 5-22-07-00519 (Beilstein Handbook Reference), Malonic acid, ((1-(p-chlorobenzoyl)-5-methoxy-2-methyl-3-indolyl)acetyl)-, diethyl ester, ((1-(p-Chlorobenzoyl)-5-methoxy-2-methyl-3-indolyl)acetyl)malonic acid diethyl ester, 2-(1-p-Clorobenzoil-2-metil-5-metossi-3-indolilacetil)-malonato dietilico [Italian]
| Molecular Formula | C26H26ClNO7 |
|---|---|
| Molecular Weight | 499.14 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 499.13977 |
| Heavy Atoms | 35 |
| Complexity | 764.0 |
Chemical Identifiers
| CAS Number | 57846-34-1 |
|---|---|
| SMILES | CCOC(=O)C(C(=O)CC1=C(N(C2=C1C=C(C=C2)OC)C(=O)C3=CC=C(C=C3)Cl)C)C(=O)OCC |
| InChIKey | HLEVUODDKUBNNF-UHFFFAOYSA-N |
Product Overview
RefChem:351827 (CAS 57846-34-1), with molecular formula C26H26ClNO7 and molecular weight 499.14 g/mol. IUPAC: diethyl 2-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]propanedioate.
Chemical Property Profile of RefChem:351827
Property Insights of RefChem:351827
The XLogP value of 5.3 indicates that RefChem:351827 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:351827. Following Lipinski's Rule of Five, RefChem:351827 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:351827?
The CAS number of RefChem:351827 is 57846-34-1.
What is the molecular formula of RefChem:351827?
The molecular formula of RefChem:351827 is C26H26ClNO7.
What is the molecular weight of RefChem:351827?
The molecular weight of RefChem:351827 is 499.14 g/mol.
Where can I buy RefChem:351827?
You can request a quote for RefChem:351827 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:351827?
Yes, KEHONG BIO provides custom synthesis services for RefChem:351827 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.