About 8-[(1-butyl-5-fluoroindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;tris(carbon dioxide);4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,3,4-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;8-[(5-fluoro-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;8-[(6-methoxy-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;4-[8-[[1-methyl-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid
8-[(1-butyl-5-fluoroindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;tris(carbon dioxide);4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,3,4-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;8-[(5-fluoro-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;8-[(6-methoxy-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;4-[8-[[1-methyl-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid (PubChem CID 158624713) has the molecular formula C164H161Cl2F11N24O25
and a molecular weight of 3148.12 g/mol. Its IUPAC name is 8-[(1-butyl-5-fluoroindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;tris(carbon dioxide);4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,3,4-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;8-[(5-fluoro-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;8-[(6-methoxy-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;4-[8-[[1-methyl-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid.
Frequently Asked Questions
What is the IUPAC name of 8-[(1-butyl-5-fluoroindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;tris(carbon dioxide);4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,3,4-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;8-[(5-fluoro-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;8-[(6-methoxy-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;4-[8-[[1-methyl-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid?
The IUPAC name of 8-[(1-butyl-5-fluoroindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;tris(carbon dioxide);4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,3,4-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;8-[(5-fluoro-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;8-[(6-methoxy-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;4-[8-[[1-methyl-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid (CID 158624713) is 8-[(1-butyl-5-fluoroindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;tris(carbon dioxide);4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,3,4-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;8-[(5-fluoro-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;8-[(6-methoxy-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;4-[8-[[1-methyl-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid.
What is the SMILES notation for 8-[(1-butyl-5-fluoroindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;tris(carbon dioxide);4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,3,4-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;8-[(5-fluoro-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;8-[(6-methoxy-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;4-[8-[[1-methyl-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid?
The canonical SMILES for 8-[(1-butyl-5-fluoroindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;tris(carbon dioxide);4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,3,4-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;8-[(5-fluoro-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;8-[(6-methoxy-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;4-[8-[[1-methyl-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid is CC(C)n1nc(CN2CCC3(CC2)CN(c2ccccc2)C(=O)O3)c2cc(F)ccc21.CCCCn1nc(CN2CCC3(CC2)CN(c2ccccc2)C(=O)O3)c2cc(F)ccc21.COc1ccc2c(CN3CCC4(CC3)CN(c3ccccc3)C(=O)O4)nn(C(C)C)c2c1.Cn1cc(-c2cc(F)c(F)cc2F)c(CN2CCC3(CC2)CN(c2ccc(C(=O)O)cc2)C(=O)O3)n1.O=C(O)c1ccc(N2CC3(CCN(Cc4nn(Cc5ccc(Cl)cc5)cc4-c4cc(F)c(F)cc4F)CC3)OC2=O)cc1.O=C(O)c1ccc(N2CC3(CCN(Cc4nn(Cc5ccc(Cl)cc5)cc4-c4ccc(F)c(F)c4F)CC3)OC2=O)cc1.O=C=O.O=C=O.O=C=O.
What is the InChIKey of 8-[(1-butyl-5-fluoroindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;tris(carbon dioxide);4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,3,4-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;8-[(5-fluoro-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;8-[(6-methoxy-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;4-[8-[[1-methyl-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid?
The InChIKey is HYLDQNFAORDFJS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C31H26ClF3N4O4.C25H23F3N4O4.C25H29FN4O2.C25H30N4O3.C24H27FN4O2.3CO2/c32-21-5-1-19(2-6-21)15-38-16-24(23-13-26(34)27(35)14-25(23)33)28(36-38)17-37-11-9-31(10-12-37)18-39(30(42)43-31)22-7-3-20(4-8-22)29(40)41;32-21-5-1-19(2-6-21)15-38-16-24(23-9-10-25(33)28(35)27(23)34)26(36-38)17-37-13-11-31(12-14-37)18-39(30(42)43-31)22-7-3-20(4-8-22)29(40)41;1-30-12-18(17-10-20(27)21(28)11-19(17)26)22(29-30)13-31-8-6-25(7-9-31)14-32(24(35)36-25)16-4-2-15(3-5-16)23(33)34;1-2-3-13-30-23-10-9-19(26)16-21(23)22(27-30)17-28-14-11-25(12-15-28)18-29(24(31)32-25)20-7-5-4-6-8-20;1-18(2)29-23-15-20(31-3)9-10-21(23)22(26-29)16-27-13-11-25(12-14-27)17-28(24(30)32-25)19-7-5-4-6-8-19;1-17(2)29-22-9-8-18(25)14-20(22)21(26-29)15-27-12-10-24(11-13-27)16-28(23(30)31-24)19-6-4-3-5-7-19;3*2-1-3/h1-8,13-14,16H,9-12,15,17-18H2,(H,40,41);1-10,16H,11-15,17-18H2,(H,40,41);2-5,10-12H,6-9,13-14H2,1H3,(H,33,34);4-10,16H,2-3,11-15,17-18H2,1H3;4-10,15,18H,11-14,16-17H2,1-3H3;3-9,14,17H,10-13,15-16H2,1-2H3;;;.
What are the key properties of 8-[(1-butyl-5-fluoroindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;tris(carbon dioxide);4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,3,4-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;8-[(5-fluoro-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;8-[(6-methoxy-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;4-[8-[[1-methyl-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid?
8-[(1-butyl-5-fluoroindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;tris(carbon dioxide);4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,3,4-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;8-[(5-fluoro-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;8-[(6-methoxy-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;4-[8-[[1-methyl-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid has a molecular weight of 3148.12 g/mol, XLogP of 29.49, 34 rotatable bonds, 3 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(1-butyl-5-fluoroindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;tris(carbon dioxide);4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,3,4-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;4-[8-[[1-[(4-chlorophenyl)methyl]-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid;8-[(5-fluoro-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;8-[(6-methoxy-1-propan-2-ylindazol-3-yl)methyl]-3-phenyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one;4-[8-[[1-methyl-4-(2,4,5-trifluorophenyl)pyrazol-3-yl]methyl]-2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]benzoic acid is sourced from PubChem (CID 158624713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).