10J-908
TL;DR: 10J-908 (CAS 337921-06-9) is a chemical compound with molecular formula C21H17ClF6N4O3S and molecular weight 554.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[4-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-3-oxo-7-(trifluoromethyl)quinoxalin-2-yl]sulfanylacetate
Also Known As: 10J-908, Ethyl 2-((4-(2-((3-chloro-5-(trifluoromethyl)-2-pyridinyl)amino)ethyl)-3-oxo-7-(trifluoromethyl)-3,4-dihydro-2-quinoxalinyl)sulfanyl)acetate, ethyl 2-[4-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-3-oxo-7-(trifluoromethyl)quinoxalin-2-yl]sulfanylacetate, ethyl 2-{[4-(2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino}ethyl)-3-oxo-7-(trifluoromethyl)-3,4-dihydroquinoxalin-2-yl]sulfanyl}acetate, ethyl 2-{[4-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}ethyl)-3-oxo-7-(trifluoromethyl)-3,4-dihydro-2-quinoxalinyl]sulfanyl}acetate
| Molecular Formula | C21H17ClF6N4O3S |
|---|---|
| Molecular Weight | 554.06 g/mol |
| LogP | 5.2498 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 554.0614 |
| Heavy Atoms | 36 |
| Complexity | 1329.966 |
Chemical Identifiers
| CAS Number | 337921-06-9 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=C(C=CC(=C2)C(F)(F)F)N(C1=O)CCNC3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
10J-908 (CAS 337921-06-9), with molecular formula C21H17ClF6N4O3S and molecular weight 554.06 g/mol. IUPAC: ethyl 2-[4-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-3-oxo-7-(trifluoromethyl)quinoxalin-2-yl]sulfanylacetate.
Chemical Property Profile of 10J-908
Property Insights of 10J-908
The XLogP value of 5.2498 indicates that 10J-908 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 10J-908. Following Lipinski's Rule of Five, 10J-908 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 10J-908?
The CAS number of 10J-908 is 337921-06-9.
What is the molecular formula of 10J-908?
The molecular formula of 10J-908 is C21H17ClF6N4O3S.
What is the molecular weight of 10J-908?
The molecular weight of 10J-908 is 554.06 g/mol.
Where can I buy 10J-908?
You can request a quote for 10J-908 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10J-908?
Yes, KEHONG BIO provides custom synthesis services for 10J-908 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.