A3392/0143909
TL;DR: A3392/0143909 (CAS 696626-17-2) is a chemical compound with molecular formula C18H22N8O2 and molecular weight 382.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-5-phenyltriazole-4-carboxylate
Also Known As: A3392/0143909, ethyl 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-5-phenyl-1H-1,2,3-triazole-4-carboxylate, ethyl 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-5-phenyltriazole-4-carboxylate, 1H-[1,2,3]Triazole-4-carboxylic acid, 1-(4,6-bisdimethylamino-[1,3,5]triazin-2-yl)-5-phenyl-, ethyl ester, ethyl 1-(4,6-bis(dimethylamino)-1,3,5-triazin-2-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylate
| Molecular Formula | C18H22N8O2 |
|---|---|
| Molecular Weight | 382.19 g/mol |
| LogP | 1.428 |
| Topological Polar Surface Area | 102.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.18658 |
| Heavy Atoms | 28 |
| Complexity | 942.72186 |
Chemical Identifiers
| CAS Number | 696626-17-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(N=N1)C2=NC(=NC(=N2)N(C)C)N(C)C)C3=CC=CC=C3 |
Product Overview
A3392/0143909 (CAS 696626-17-2), with molecular formula C18H22N8O2 and molecular weight 382.19 g/mol. IUPAC: ethyl 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-5-phenyltriazole-4-carboxylate.
Chemical Property Profile of A3392/0143909
Property Insights of A3392/0143909
The XLogP value of 1.428 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3392/0143909. The TPSA of 102.16 Ų falls within the moderate polarity range, balancing permeability and solubility for A3392/0143909. Following Lipinski's Rule of Five, A3392/0143909 has 0 hydrogen bond donor(s) and 9 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 A3392/0143909?
The CAS number of A3392/0143909 is 696626-17-2.
What is the molecular formula of A3392/0143909?
The molecular formula of A3392/0143909 is C18H22N8O2.
What is the molecular weight of A3392/0143909?
The molecular weight of A3392/0143909 is 382.19 g/mol.
Where can I buy A3392/0143909?
You can request a quote for A3392/0143909 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3392/0143909?
Yes, KEHONG BIO provides custom synthesis services for A3392/0143909 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.