A1692/0072195
TL;DR: A1692/0072195 (CAS 312266-86-7) is a chemical compound with molecular formula C21H18F3N5OS and molecular weight 445.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Also Known As: A1692/0072195, 2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide, 2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide, 2-({5-PROPYL-5H-[1,2,4]TRIAZINO[5,6-B]INDOL-3-YL}SULFANYL)-N-[3-(TRIFLUOROMETHYL)PHENYL]ACETAMIDE
| Molecular Formula | C21H18F3N5OS |
|---|---|
| Molecular Weight | 445.12 g/mol |
| LogP | 5.1391 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.1184 |
| Heavy Atoms | 31 |
| Complexity | 1254.9602 |
Chemical Identifiers
| CAS Number | 312266-86-7 |
|---|---|
| SMILES | CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC4=CC=CC(=C4)C(F)(F)F |
Product Overview
A1692/0072195 (CAS 312266-86-7), with molecular formula C21H18F3N5OS and molecular weight 445.12 g/mol. IUPAC: 2-[(5-propyl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of A1692/0072195
Property Insights of A1692/0072195
The XLogP value of 5.1391 indicates that A1692/0072195 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for A1692/0072195. Following Lipinski's Rule of Five, A1692/0072195 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1692/0072195?
The CAS number of A1692/0072195 is 312266-86-7.
What is the molecular formula of A1692/0072195?
The molecular formula of A1692/0072195 is C21H18F3N5OS.
What is the molecular weight of A1692/0072195?
The molecular weight of A1692/0072195 is 445.12 g/mol.
Where can I buy A1692/0072195?
You can request a quote for A1692/0072195 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1692/0072195?
Yes, KEHONG BIO provides custom synthesis services for A1692/0072195 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.