![3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline structure](/static/products/3947/39478-67-6.webp)
3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline
TL;DR: 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline (CAS 39478-67-6) is a chemical compound with molecular formula C28H22Cl2F3N3O2 and molecular weight 559.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,10-bis[(4-chlorophenyl)methyl]-16-(trifluoromethyl)-3,12-dioxa-5,10,15-triazatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),8(13),15,17-pentaene
Also Known As: 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline, 3,6-Bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrodi[1,3]oxazino[6,5-f:5,6-H]quinoline #, 3,6-Bis[(4-chlorophenyl)methyl]-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline, 5,10-Bis[(4-chlorophenyl)methyl]-16-(trifluoromethyl)-3,12-dioxa-5,10,15-triazatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),8(13),15,17-pentaene, Bis-[1,3]-oxazino[6,5-f:5',6'-H]quinoline,3,6-bis(4-chlorobenzyl)-10-trifluoromethyl-3,4,5,6(2H,7H)-tetrahydro-
| Molecular Formula | C28H22Cl2F3N3O2 |
|---|---|
| Molecular Weight | 559.10 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 37.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 559.1041 |
| Heavy Atoms | 38 |
| Complexity | 794.0 |
Chemical Identifiers
| CAS Number | 39478-67-6 |
|---|---|
| SMILES | C1C2=C(C3=C(C4=C2CN(CO4)CC5=CC=C(C=C5)Cl)N=C(C=C3)C(F)(F)F)OCN1CC6=CC=C(C=C6)Cl |
| InChIKey | GBPSHGIXMXUSIG-UHFFFAOYSA-N |
Product Overview
3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline (CAS 39478-67-6), with molecular formula C28H22Cl2F3N3O2 and molecular weight 559.10 g/mol. IUPAC: 5,10-bis[(4-chlorophenyl)methyl]-16-(trifluoromethyl)-3,12-dioxa-5,10,15-triazatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),8(13),15,17-pentaene.
Chemical Property Profile of 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline
Property Insights of 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline
The XLogP value of 6.7 indicates that 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.8 Ų, 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline?
The CAS number of 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline is 39478-67-6.
What is the molecular formula of 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline?
The molecular formula of 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline is C28H22Cl2F3N3O2.
What is the molecular weight of 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline?
The molecular weight of 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline is 559.10 g/mol.
Where can I buy 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline?
You can request a quote for 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline?
Yes, KEHONG BIO provides custom synthesis services for 3,6-bis(4-chlorobenzyl)-10-(trifluoromethyl)-2,3,4,5,6,7-hexahydrobis[1,3]oxazino[6,5-f:5',6'-h]quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.