AN-329/40487306
TL;DR: AN-329/40487306 (CAS 327065-29-2) is a chemical compound with molecular formula C17H18N6O6S and molecular weight 434.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2E)-2-cyano-2-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]hydrazinylidene]acetate
Also Known As: AN-329/40487306, ethyl cyano[(4-{[(2,6-dimethoxypyrimidin-4-yl)amino]sulfonyl}phenyl)hydrazono]acetate, ethyl (2E)-2-cyano-2-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]hydrazinylidene]acetate, ethyl cyano[(4-{[(2,6-dimethoxy-4-pyrimidinyl)amino]sulfonyl}phenyl)hydrazono]acetate, ethyl (2E)-3-[(4-{[(2,6-dimethoxypyrimidin-4-yl)amino]sulfonyl}phenyl)amino]-2 -cyano-3-azaprop-2-enoate
| Molecular Formula | C17H18N6O6S |
|---|---|
| Molecular Weight | 434.10 g/mol |
| LogP | 1.14918 |
| Topological Polar Surface Area | 164.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 434.10086 |
| Heavy Atoms | 30 |
| Complexity | 1056.6577 |
Chemical Identifiers
| CAS Number | 327065-29-2 |
|---|---|
| SMILES | CCOC(=O)/C(=N/NC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=NC(=N2)OC)OC)/C#N |
Product Overview
AN-329/40487306 (CAS 327065-29-2), with molecular formula C17H18N6O6S and molecular weight 434.10 g/mol. IUPAC: ethyl (2E)-2-cyano-2-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]hydrazinylidene]acetate.
Chemical Property Profile of AN-329/40487306
Property Insights of AN-329/40487306
The XLogP value of 1.14918 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AN-329/40487306. The TPSA of 164.89 Ų indicates high polarity, suggesting AN-329/40487306 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AN-329/40487306 has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-329/40487306?
The CAS number of AN-329/40487306 is 327065-29-2.
What is the molecular formula of AN-329/40487306?
The molecular formula of AN-329/40487306 is C17H18N6O6S.
What is the molecular weight of AN-329/40487306?
The molecular weight of AN-329/40487306 is 434.10 g/mol.
Where can I buy AN-329/40487306?
You can request a quote for AN-329/40487306 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/40487306?
Yes, KEHONG BIO provides custom synthesis services for AN-329/40487306 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.