AQ-750/41791585
TL;DR: AQ-750/41791585 (CAS 670272-92-1) is a chemical compound with molecular formula C25H29N3O3S and molecular weight 451.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3-cyano-4-ethyl-7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(4-ethoxyphenyl)propanamide
Also Known As: AQ-750/41791585, 3-[(3-cyano-4-ethyl-7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(4-ethoxyphenyl)propanamide, 3-((3-cyano-4-ethyl-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)thio)-N-(4-ethoxyphenyl)propanamide, 3-[(3-cyano-4-ethyl-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-ethoxyphenyl)propanamide, 3-[(3-cyano-4-ethyl-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-2-quinolinyl)sulfanyl]-N-(4-ethoxyphenyl)propanamide
| Molecular Formula | C25H29N3O3S |
|---|---|
| Molecular Weight | 451.19 g/mol |
| LogP | 5.19038 |
| Topological Polar Surface Area | 92.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 451.19296 |
| Heavy Atoms | 32 |
| Complexity | 1055.5823 |
Chemical Identifiers
| CAS Number | 670272-92-1 |
|---|---|
| SMILES | CCC1=C(C(=NC2=C1C(=O)CC(C2)(C)C)SCCC(=O)NC3=CC=C(C=C3)OCC)C#N |
Product Overview
AQ-750/41791585 (CAS 670272-92-1), with molecular formula C25H29N3O3S and molecular weight 451.19 g/mol. IUPAC: 3-[(3-cyano-4-ethyl-7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(4-ethoxyphenyl)propanamide.
Chemical Property Profile of AQ-750/41791585
Property Insights of AQ-750/41791585
The XLogP value of 5.19038 indicates that AQ-750/41791585 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.08 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-750/41791585. Following Lipinski's Rule of Five, AQ-750/41791585 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AQ-750/41791585?
The CAS number of AQ-750/41791585 is 670272-92-1.
What is the molecular formula of AQ-750/41791585?
The molecular formula of AQ-750/41791585 is C25H29N3O3S.
What is the molecular weight of AQ-750/41791585?
The molecular weight of AQ-750/41791585 is 451.19 g/mol.
Where can I buy AQ-750/41791585?
You can request a quote for AQ-750/41791585 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-750/41791585?
Yes, KEHONG BIO provides custom synthesis services for AQ-750/41791585 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.