2L-016
TL;DR: 2L-016 (CAS 338775-17-0) is a chemical compound with molecular formula C17H9ClF3N5S and molecular weight 407.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-7-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine
Also Known As: 2L-016, 2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-7-phenyl[1,2,4]triazolo[1,5-a]pyrimidine, 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-7-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine, 2-((3-Chloro-5-(trifluoromethyl)-2-pyridinyl)sulfanyl)-7-phenyl)(1,2,4)triazolo[1,5-a]pyrimidine, 2-((3-Chloro-5-(trifluoromethyl)pyridin-2-yl)thio)-7-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine
| Molecular Formula | C17H9ClF3N5S |
|---|---|
| Molecular Weight | 407.02 g/mol |
| LogP | 5.0097 |
| Topological Polar Surface Area | 55.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 407.02194 |
| Heavy Atoms | 27 |
| Complexity | 1114.7103 |
Chemical Identifiers
| CAS Number | 338775-17-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=NC3=NC(=NN23)SC4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
2L-016 (CAS 338775-17-0), with molecular formula C17H9ClF3N5S and molecular weight 407.02 g/mol. IUPAC: 2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-7-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine.
Chemical Property Profile of 2L-016
Property Insights of 2L-016
The XLogP value of 5.0097 indicates that 2L-016 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.97 Ų, 2L-016 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2L-016 has 0 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 2L-016?
The CAS number of 2L-016 is 338775-17-0.
What is the molecular formula of 2L-016?
The molecular formula of 2L-016 is C17H9ClF3N5S.
What is the molecular weight of 2L-016?
The molecular weight of 2L-016 is 407.02 g/mol.
Where can I buy 2L-016?
You can request a quote for 2L-016 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2L-016?
Yes, KEHONG BIO provides custom synthesis services for 2L-016 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.