![2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide structure](/static/products/900/900897-80-5.png)
2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide
TL;DR: 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide (CAS 900897-80-5) is a chemical compound with molecular formula C28H28N6O2S and molecular weight 512.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[8-cyano-11,11-dimethyl-7-(4-methylanilino)-12-oxa-3,4,6-triazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7-tetraen-5-yl]sulfanyl]-N-methyl-N-phenylacetamide
Also Known As: 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide, 2-({6-cyano-8,8-dimethyl-5-[(4-methylphenyl)amino]-7,10-dihydro-8H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl}sulfanyl)-N-methyl-N-phenylacetamide
| Molecular Formula | C28H28N6O2S |
|---|---|
| Molecular Weight | 512.20 g/mol |
| LogP | 5.2594 |
| Topological Polar Surface Area | 95.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 512.19946 |
| Heavy Atoms | 37 |
| Complexity | 1506.205 |
Chemical Identifiers
| CAS Number | 900897-80-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=C(C3=C(COC(C3)(C)C)C4=NN=C(N24)SCC(=O)N(C)C5=CC=CC=C5)C#N |
Product Overview
2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide (CAS 900897-80-5), with molecular formula C28H28N6O2S and molecular weight 512.20 g/mol. IUPAC: 2-[[8-cyano-11,11-dimethyl-7-(4-methylanilino)-12-oxa-3,4,6-triazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7-tetraen-5-yl]sulfanyl]-N-methyl-N-phenylacetamide.
Chemical Property Profile of 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide
Property Insights of 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide
The XLogP value of 5.2594 indicates that 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide. Following Lipinski's Rule of Five, 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide has 1 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-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide?
The CAS number of 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide is 900897-80-5.
What is the molecular formula of 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide?
The molecular formula of 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide is C28H28N6O2S.
What is the molecular weight of 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide?
The molecular weight of 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide is 512.20 g/mol.
Where can I buy 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide?
You can request a quote for 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((6-cyano-8,8-dimethyl-5-(p-tolylamino)-8,10-dihydro-7H-pyrano[3,4-c][1,2,4]triazolo[4,3-a]pyridin-3-yl)thio)-N-methyl-N-phenylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.