A3865/0164178
TL;DR: A3865/0164178 (CAS 728029-06-9) is a chemical compound with molecular formula C24H26N2O6 and molecular weight 438.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 4-[(6-methoxy-2-oxochromene-3-carbonyl)amino]benzoate
Also Known As: A3865/0164178, 2-(diethylamino)ethyl 4-{[(6-methoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}benzoate, 2-diethylaminoethyl 4-[(6-methoxy-2-oxochromene-3-carbonyl)amino]benzoate, 2-(diethylamino)ethyl 4-(6-methoxy-2-oxo-2H-chromene-3-carboxamido)benzoate
| Molecular Formula | C24H26N2O6 |
|---|---|
| Molecular Weight | 438.18 g/mol |
| LogP | 3.5525 |
| Topological Polar Surface Area | 98.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 438.17908 |
| Heavy Atoms | 32 |
| Complexity | 1149.3583 |
Chemical Identifiers
| CAS Number | 728029-06-9 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC(=C3)OC)OC2=O |
Product Overview
A3865/0164178 (CAS 728029-06-9), with molecular formula C24H26N2O6 and molecular weight 438.18 g/mol. IUPAC: 2-(diethylamino)ethyl 4-[(6-methoxy-2-oxochromene-3-carbonyl)amino]benzoate.
Chemical Property Profile of A3865/0164178
Property Insights of A3865/0164178
The XLogP value of 3.5525 indicates that A3865/0164178 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.08 Ų falls within the moderate polarity range, balancing permeability and solubility for A3865/0164178. Following Lipinski's Rule of Five, A3865/0164178 has 1 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 A3865/0164178?
The CAS number of A3865/0164178 is 728029-06-9.
What is the molecular formula of A3865/0164178?
The molecular formula of A3865/0164178 is C24H26N2O6.
What is the molecular weight of A3865/0164178?
The molecular weight of A3865/0164178 is 438.18 g/mol.
Where can I buy A3865/0164178?
You can request a quote for A3865/0164178 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3865/0164178?
Yes, KEHONG BIO provides custom synthesis services for A3865/0164178 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.