NCI60_007735
TL;DR: NCI60_007735 (CAS 13949-89-8) is a chemical compound with molecular formula C24H34O10 and molecular weight 482.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-[[4-(3-ethoxy-2-ethoxycarbonyl-3-oxopropyl)-2,5-dimethoxyphenyl]methyl]propanedioate
Also Known As: NCI60_007735, Diethyl 2-(4-(3-ethoxy-2-(ethoxycarbonyl)-3-oxopropyl)-2,5-dimethoxybenzyl)malonate, TETRAETHYL 2,2'-(2,5-DIMETHOXY-1,4-PHENYLENEDIMETHYLENE)DIMALONATE, 2-(4-(2,2-BIS-ETHOXYCARBONYL-ET)-2,5-DIMETHOXY-BZL)-MALONIC ACID DIETHYL ESTER, diethyl 2-[[4-(3-ethoxy-2-ethoxycarbonyl-3-oxo-propyl)-2,5-dimethoxy-phenyl]methyl]propanedioate
| Molecular Formula | C24H34O10 |
|---|---|
| Molecular Weight | 482.22 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 18 |
| Exact Mass | 482.2152 |
| Heavy Atoms | 34 |
| Complexity | 572.0 |
Chemical Identifiers
| CAS Number | 13949-89-8 |
|---|---|
| SMILES | CCOC(=O)C(CC1=CC(=C(C=C1OC)CC(C(=O)OCC)C(=O)OCC)OC)C(=O)OCC |
| InChIKey | WDWSEYBZJVGBMV-UHFFFAOYSA-N |
Product Overview
NCI60_007735 (CAS 13949-89-8), with molecular formula C24H34O10 and molecular weight 482.22 g/mol. IUPAC: diethyl 2-[[4-(3-ethoxy-2-ethoxycarbonyl-3-oxopropyl)-2,5-dimethoxyphenyl]methyl]propanedioate.
Chemical Property Profile of NCI60_007735
Property Insights of NCI60_007735
The XLogP value of 3.7 indicates that NCI60_007735 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for NCI60_007735. Following Lipinski's Rule of Five, NCI60_007735 has 0 hydrogen bond donor(s) and 10 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 NCI60_007735?
The CAS number of NCI60_007735 is 13949-89-8.
What is the molecular formula of NCI60_007735?
The molecular formula of NCI60_007735 is C24H34O10.
What is the molecular weight of NCI60_007735?
The molecular weight of NCI60_007735 is 482.22 g/mol.
Where can I buy NCI60_007735?
You can request a quote for NCI60_007735 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_007735?
Yes, KEHONG BIO provides custom synthesis services for NCI60_007735 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.