![2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide structure](/static/products/900/900869-34-3.png)
2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide
TL;DR: 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide (CAS 900869-34-3) is a chemical compound with molecular formula C26H23ClN6O2S and molecular weight 518.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(7-anilino-8-cyano-11,11-dimethyl-12-oxa-3,4,6-triazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7-tetraen-5-yl)sulfanyl]-N-(4-chlorophenyl)acetamide
Also Known As: 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide, N-(4-chlorophenyl)-2-((6-cyano-8,8-dimethyl-5-(phenylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)acetamide, N-(4-chlorophenyl)-2-{[6-cyano-8,8-dimethyl-5-(phenylamino)-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl]sulfanyl}acetamide
| Molecular Formula | C26H23ClN6O2S |
|---|---|
| Molecular Weight | 518.13 g/mol |
| LogP | 5.58008 |
| Topological Polar Surface Area | 104.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 518.12915 |
| Heavy Atoms | 36 |
| Complexity | 1478.8395 |
Chemical Identifiers
| CAS Number | 900869-34-3 |
|---|---|
| SMILES | CC1(CC2=C(CO1)C3=NN=C(N3C(=C2C#N)NC4=CC=CC=C4)SCC(=O)NC5=CC=C(C=C5)Cl)C |
Product Overview
2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide (CAS 900869-34-3), with molecular formula C26H23ClN6O2S and molecular weight 518.13 g/mol. IUPAC: 2-[(7-anilino-8-cyano-11,11-dimethyl-12-oxa-3,4,6-triazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7-tetraen-5-yl)sulfanyl]-N-(4-chlorophenyl)acetamide.
Chemical Property Profile of 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide
Property Insights of 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide
The XLogP value of 5.58008 indicates that 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide. Following Lipinski's Rule of Five, 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide?
The CAS number of 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide is 900869-34-3.
What is the molecular formula of 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide?
The molecular formula of 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide is C26H23ClN6O2S.
What is the molecular weight of 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide?
The molecular weight of 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide is 518.13 g/mol.
Where can I buy 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide?
You can request a quote for 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(5-anilino-6-cyano-8,8-dimethyl-7,10-dihydro-8h-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio]-N-(4-chlorophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.