A3409/0144604
TL;DR: A3409/0144604 (CAS 209048-45-3) is a chemical compound with molecular formula C14H12ClNO5 and molecular weight 309.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-chloro-6-methoxy-4-[(Z)-(2-methyl-5-oxo-1,3-oxazol-4-ylidene)methyl]phenyl] acetate
Also Known As: A3409/0144604, (Z)-2-chloro-6-methoxy-4-((2-methyl-5-oxooxazol-4(5H)-ylidene)methyl)phenyl acetate, [2-chloro-6-methoxy-4-[(Z)-(2-methyl-5-oxo-1,3-oxazol-4-ylidene)methyl]phenyl] acetate, 2-chloro-6-methoxy-4-[(2-methyl-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]phenyl acetate, 2-chloro-6-methoxy-4-[(Z)-(2-methyl-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]phenyl acetate
| Molecular Formula | C14H12ClNO5 |
|---|---|
| Molecular Weight | 309.04 g/mol |
| LogP | 2.59 |
| Topological Polar Surface Area | 74.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.0404 |
| Heavy Atoms | 21 |
| Complexity | 678.1871 |
Chemical Identifiers
| CAS Number | 209048-45-3 |
|---|---|
| SMILES | CC1=N/C(=C\C2=CC(=C(C(=C2)Cl)OC(=O)C)OC)/C(=O)O1 |
Product Overview
A3409/0144604 (CAS 209048-45-3), with molecular formula C14H12ClNO5 and molecular weight 309.04 g/mol. IUPAC: [2-chloro-6-methoxy-4-[(Z)-(2-methyl-5-oxo-1,3-oxazol-4-ylidene)methyl]phenyl] acetate.
Chemical Property Profile of A3409/0144604
Property Insights of A3409/0144604
The XLogP value of 2.59 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3409/0144604. The TPSA of 74.19 Ų falls within the moderate polarity range, balancing permeability and solubility for A3409/0144604. Following Lipinski's Rule of Five, A3409/0144604 has 0 hydrogen bond donor(s) and 6 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 A3409/0144604?
The CAS number of A3409/0144604 is 209048-45-3.
What is the molecular formula of A3409/0144604?
The molecular formula of A3409/0144604 is C14H12ClNO5.
What is the molecular weight of A3409/0144604?
The molecular weight of A3409/0144604 is 309.04 g/mol.
Where can I buy A3409/0144604?
You can request a quote for A3409/0144604 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3409/0144604?
Yes, KEHONG BIO provides custom synthesis services for A3409/0144604 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.