A2509/0106612
TL;DR: A2509/0106612 (CAS 405279-40-5) is a chemical compound with molecular formula C20H17F2N5OS and molecular weight 413.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-difluorophenyl)-2-[(5-propan-2-yl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Also Known As: A2509/0106612, N-(2,4-difluorophenyl)-2-[(5-propan-2-yl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide, N-(2,4-difluorophenyl)-2-[(5-isopropyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]acetamide, N-(2,4-difluorophenyl)-2-{[5-(propan-2-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamide
| Molecular Formula | C20H17F2N5OS |
|---|---|
| Molecular Weight | 413.11 g/mol |
| LogP | 4.5694 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.11218 |
| Heavy Atoms | 29 |
| Complexity | 1224.4235 |
Chemical Identifiers
| CAS Number | 405279-40-5 |
|---|---|
| SMILES | CC(C)N1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC4=C(C=C(C=C4)F)F |
Product Overview
A2509/0106612 (CAS 405279-40-5), with molecular formula C20H17F2N5OS and molecular weight 413.11 g/mol. IUPAC: N-(2,4-difluorophenyl)-2-[(5-propan-2-yl-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of A2509/0106612
Property Insights of A2509/0106612
The XLogP value of 4.5694 indicates that A2509/0106612 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 A2509/0106612. Following Lipinski's Rule of Five, A2509/0106612 has 1 hydrogen bond donor(s) and 5 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 A2509/0106612?
The CAS number of A2509/0106612 is 405279-40-5.
What is the molecular formula of A2509/0106612?
The molecular formula of A2509/0106612 is C20H17F2N5OS.
What is the molecular weight of A2509/0106612?
The molecular weight of A2509/0106612 is 413.11 g/mol.
Where can I buy A2509/0106612?
You can request a quote for A2509/0106612 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2509/0106612?
Yes, KEHONG BIO provides custom synthesis services for A2509/0106612 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.