About 6-chloro-N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoroquinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoxaline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-6-(trifluoromethyl)quinazoline-2-carboxamide;N-[(3S,6R)-6-[5-(2-ethoxyethoxy)-1,3,4-oxadiazol-2-yl]oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide;N-[(3S,6R)-6-(5-propoxy-1,3,4-oxadiazol-2-yl)oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide
6-chloro-N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoroquinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoxaline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-6-(trifluoromethyl)quinazoline-2-carboxamide;N-[(3S,6R)-6-[5-(2-ethoxyethoxy)-1,3,4-oxadiazol-2-yl]oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide;N-[(3S,6R)-6-(5-propoxy-1,3,4-oxadiazol-2-yl)oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide (PubChem CID 165089465) has the molecular formula C124H125ClF26N24O31
and a molecular weight of 2976.90 g/mol. Its IUPAC name is 6-chloro-N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoroquinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoxaline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-6-(trifluoromethyl)quinazoline-2-carboxamide;N-[(3S,6R)-6-[5-(2-ethoxyethoxy)-1,3,4-oxadiazol-2-yl]oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide;N-[(3S,6R)-6-(5-propoxy-1,3,4-oxadiazol-2-yl)oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide.
Frequently Asked Questions
What is the IUPAC name of 6-chloro-N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoroquinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoxaline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-6-(trifluoromethyl)quinazoline-2-carboxamide;N-[(3S,6R)-6-[5-(2-ethoxyethoxy)-1,3,4-oxadiazol-2-yl]oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide;N-[(3S,6R)-6-(5-propoxy-1,3,4-oxadiazol-2-yl)oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide?
The IUPAC name of 6-chloro-N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoroquinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoxaline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-6-(trifluoromethyl)quinazoline-2-carboxamide;N-[(3S,6R)-6-[5-(2-ethoxyethoxy)-1,3,4-oxadiazol-2-yl]oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide;N-[(3S,6R)-6-(5-propoxy-1,3,4-oxadiazol-2-yl)oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide (CID 165089465) is 6-chloro-N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoroquinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoxaline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-6-(trifluoromethyl)quinazoline-2-carboxamide;N-[(3S,6R)-6-[5-(2-ethoxyethoxy)-1,3,4-oxadiazol-2-yl]oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide;N-[(3S,6R)-6-(5-propoxy-1,3,4-oxadiazol-2-yl)oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide.
What is the SMILES notation for 6-chloro-N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoroquinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoxaline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-6-(trifluoromethyl)quinazoline-2-carboxamide;N-[(3S,6R)-6-[5-(2-ethoxyethoxy)-1,3,4-oxadiazol-2-yl]oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide;N-[(3S,6R)-6-(5-propoxy-1,3,4-oxadiazol-2-yl)oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide?
The canonical SMILES for 6-chloro-N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoroquinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoxaline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-6-(trifluoromethyl)quinazoline-2-carboxamide;N-[(3S,6R)-6-[5-(2-ethoxyethoxy)-1,3,4-oxadiazol-2-yl]oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide;N-[(3S,6R)-6-(5-propoxy-1,3,4-oxadiazol-2-yl)oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide is CC(F)(F)OCCOc1nnc([C@H]2CC[C@H](NC(=O)c3ccc4cc(C(F)(F)F)c(F)cc4n3)CO2)o1.CC(F)(F)OCCOc1nnc([C@H]2CC[C@H](NC(=O)c3ccc4cc(Cl)c(F)cc4n3)CO2)o1.CC(F)(F)OCCOc1nnc([C@H]2CC[C@H](NC(=O)c3cnc4cc(C(F)(F)F)c(F)cc4n3)CO2)o1.CC(F)(F)OCCOc1nnc([C@H]2CC[C@H](NC(=O)c3ncc4cc(C(F)(F)F)ccc4n3)CO2)o1.CCCOc1nnc([C@H]2CC[C@H](NC(=O)COc3ccc(C(F)(F)F)cc3)CO2)o1.CCOCCOc1nnc([C@H]2CC[C@H](NC(=O)COc3ccc(C(F)(F)F)cc3)CO2)o1.
What is the InChIKey of 6-chloro-N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoroquinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoxaline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-6-(trifluoromethyl)quinazoline-2-carboxamide;N-[(3S,6R)-6-[5-(2-ethoxyethoxy)-1,3,4-oxadiazol-2-yl]oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide;N-[(3S,6R)-6-(5-propoxy-1,3,4-oxadiazol-2-yl)oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide?
The InChIKey is WLOUHNIBHGIKDS-BUZHIBEYSA-N. The full InChI is InChI=1S/C22H20F6N4O5.C21H20ClF3N4O5.C21H19F6N5O5.C21H20F5N5O5.C20H24F3N3O6.C19H22F3N3O5/c1-21(24,25)36-7-6-34-20-32-31-19(37-20)17-5-3-12(10-35-17)29-18(33)15-4-2-11-8-13(22(26,27)28)14(23)9-16(11)30-15;1-21(24,25)33-7-6-31-20-29-28-19(34-20)17-5-3-12(10-32-17)26-18(30)15-4-2-11-8-13(22)14(23)9-16(11)27-15;1-20(23,24)36-5-4-34-19-32-31-18(37-19)16-3-2-10(9-35-16)29-17(33)15-8-28-13-6-11(21(25,26)27)12(22)7-14(13)30-15;1-20(22,23)35-7-6-33-19-31-30-18(36-19)15-5-3-13(10-34-15)28-17(32)16-27-9-11-8-12(21(24,25)26)2-4-14(11)29-16;1-2-28-9-10-29-19-26-25-18(32-19)16-8-5-14(11-31-16)24-17(27)12-30-15-6-3-13(4-7-15)20(21,22)23;1-2-9-27-18-25-24-17(30-18)15-8-5-13(10-29-15)23-16(26)11-28-14-6-3-12(4-7-14)19(20,21)22/h2,4,8-9,12,17H,3,5-7,10H2,1H3,(H,29,33);2,4,8-9,12,17H,3,5-7,10H2,1H3,(H,26,30);6-8,10,16H,2-5,9H2,1H3,(H,29,33);2,4,8-9,13,15H,3,5-7,10H2,1H3,(H,28,32);3-4,6-7,14,16H,2,5,8-12H2,1H3,(H,24,27);3-4,6-7,13,15H,2,5,8-11H2,1H3,(H,23,26)/t2*12-,17+;10-,16+;13-,15+;14-,16+;13-,15+/m000000/s1.
What are the key properties of 6-chloro-N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoroquinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoxaline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-6-(trifluoromethyl)quinazoline-2-carboxamide;N-[(3S,6R)-6-[5-(2-ethoxyethoxy)-1,3,4-oxadiazol-2-yl]oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide;N-[(3S,6R)-6-(5-propoxy-1,3,4-oxadiazol-2-yl)oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide?
6-chloro-N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoroquinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoxaline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-6-(trifluoromethyl)quinazoline-2-carboxamide;N-[(3S,6R)-6-[5-(2-ethoxyethoxy)-1,3,4-oxadiazol-2-yl]oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide;N-[(3S,6R)-6-(5-propoxy-1,3,4-oxadiazol-2-yl)oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide has a molecular weight of 2976.90 g/mol, XLogP of 22.23, 50 rotatable bonds, 6 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoroquinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-7-fluoro-6-(trifluoromethyl)quinoxaline-2-carboxamide;N-[(3S,6R)-6-[5-[2-(1,1-difluoroethoxy)ethoxy]-1,3,4-oxadiazol-2-yl]oxan-3-yl]-6-(trifluoromethyl)quinazoline-2-carboxamide;N-[(3S,6R)-6-[5-(2-ethoxyethoxy)-1,3,4-oxadiazol-2-yl]oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide;N-[(3S,6R)-6-(5-propoxy-1,3,4-oxadiazol-2-yl)oxan-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide is sourced from PubChem (CID 165089465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).