A2806/0118621
TL;DR: A2806/0118621 (CAS 446051-89-4) is a chemical compound with molecular formula C19H27NO4 and molecular weight 333.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(2,2-dimethyl-4-phenyloxan-4-yl)ethylamino]-4-oxobutanoic acid
Also Known As: A2806/0118621, 4-((2-(2,2-dimethyl-4-phenyltetrahydro-2H-pyran-4-yl)ethyl)amino)-4-oxobutanoic acid, 4-{[2-(2,2-dimethyl-4-phenyltetrahydro-2H-pyran-4-yl)ethyl]amino}-4-oxobutanoic acid, 4-[2-(2,2-dimethyl-4-phenyloxan-4-yl)ethylamino]-4-oxobutanoic acid, 3-{N-[2-(2,2-dimethyl-4-phenyl-2H-3,4,5,6-tetrahydropyran-4-yl)ethyl]carbamoyl }propanoic acid
| Molecular Formula | C19H27NO4 |
|---|---|
| Molecular Weight | 333.19 g/mol |
| LogP | 2.8845 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 333.194 |
| Heavy Atoms | 24 |
| Complexity | 569.9893 |
Chemical Identifiers
| CAS Number | 446051-89-4 |
|---|---|
| SMILES | CC1(CC(CCO1)(CCNC(=O)CCC(=O)O)C2=CC=CC=C2)C |
Product Overview
A2806/0118621 (CAS 446051-89-4), with molecular formula C19H27NO4 and molecular weight 333.19 g/mol. IUPAC: 4-[2-(2,2-dimethyl-4-phenyloxan-4-yl)ethylamino]-4-oxobutanoic acid.
Chemical Property Profile of A2806/0118621
Property Insights of A2806/0118621
The XLogP value of 2.8845 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2806/0118621. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for A2806/0118621. Following Lipinski's Rule of Five, A2806/0118621 has 2 hydrogen bond donor(s) and 3 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 A2806/0118621?
The CAS number of A2806/0118621 is 446051-89-4.
What is the molecular formula of A2806/0118621?
The molecular formula of A2806/0118621 is C19H27NO4.
What is the molecular weight of A2806/0118621?
The molecular weight of A2806/0118621 is 333.19 g/mol.
Where can I buy A2806/0118621?
You can request a quote for A2806/0118621 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2806/0118621?
Yes, KEHONG BIO provides custom synthesis services for A2806/0118621 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.