About [4-[2-cyclopropyl-6-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-3,5-difluorophenoxy]-methylphosphinic acid;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(1,1,2,2,2-pentafluoroethyl)phenyl]imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane
[4-[2-cyclopropyl-6-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-3,5-difluorophenoxy]-methylphosphinic acid;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(1,1,2,2,2-pentafluoroethyl)phenyl]imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane (PubChem CID 158280699) has the molecular formula C136H90F39N26O3PS2
and a molecular weight of 2972.42 g/mol. Its IUPAC name is [4-[2-cyclopropyl-6-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-3,5-difluorophenoxy]-methylphosphinic acid;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(1,1,2,2,2-pentafluoroethyl)phenyl]imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane.
Frequently Asked Questions
What is the IUPAC name of [4-[2-cyclopropyl-6-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-3,5-difluorophenoxy]-methylphosphinic acid;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(1,1,2,2,2-pentafluoroethyl)phenyl]imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane?
The IUPAC name of [4-[2-cyclopropyl-6-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-3,5-difluorophenoxy]-methylphosphinic acid;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(1,1,2,2,2-pentafluoroethyl)phenyl]imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane (CID 158280699) is [4-[2-cyclopropyl-6-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-3,5-difluorophenoxy]-methylphosphinic acid;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(1,1,2,2,2-pentafluoroethyl)phenyl]imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane.
What is the SMILES notation for [4-[2-cyclopropyl-6-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-3,5-difluorophenoxy]-methylphosphinic acid;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(1,1,2,2,2-pentafluoroethyl)phenyl]imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane?
The canonical SMILES for [4-[2-cyclopropyl-6-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-3,5-difluorophenoxy]-methylphosphinic acid;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(1,1,2,2,2-pentafluoroethyl)phenyl]imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane is CC(C)c1cc(-c2cn3c(-c4ccc5[nH]ncc5c4F)c(C(C)(F)F)nc3cn2)ccc1F.CC(C)c1cccc(-c2cn3c(-c4ccc5[nH]ncc5c4F)c(C(C)(F)F)nc3cn2)c1.CC(F)(F)c1nc2cnc(-c3ccc(F)c(C(F)(F)C(F)(F)F)c3)cn2c1-c1ccc2[nH]ncc2c1F.CP(=O)(O)Oc1cc(F)c(-c2c(C3CC3)nc3cnc(-c4ccc(F)c(C(F)(F)F)c4)cn23)c(F)c1.Cc1nc2cnc(-c3ccc(F)c(S(F)(F)(F)(F)F)c3)cn2c1-c1ccc2[nH]ccc2c1F.Fc1ccc(-c2cn3c(-c4ccc5[nH]ccc5c4F)c(C(F)(F)F)nc3cn2)cc1S(F)(F)(F)(F)F.
What is the InChIKey of [4-[2-cyclopropyl-6-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-3,5-difluorophenoxy]-methylphosphinic acid;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(1,1,2,2,2-pentafluoroethyl)phenyl]imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane?
The InChIKey is GKEDJZKGPRNEJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19F4N5.C24H20F3N5.C23H12F9N5.C23H16F6N3O3P.C21H10F10N4S.C21H13F7N4S/c1-12(2)15-8-13(4-6-17(15)25)19-11-33-20(10-29-19)31-23(24(3,27)28)22(33)14-5-7-18-16(21(14)26)9-30-32-18;1-13(2)14-5-4-6-15(9-14)19-12-32-20(11-28-19)30-23(24(3,26)27)22(32)16-7-8-18-17(21(16)25)10-29-31-18;1-21(26,27)20-19(11-3-5-15-12(18(11)25)7-34-36-15)37-9-16(33-8-17(37)35-20)10-2-4-14(24)13(6-10)22(28,29)23(30,31)32;1-36(33,34)35-13-7-16(25)20(17(26)8-13)22-21(11-2-3-11)31-19-9-30-18(10-32(19)22)12-4-5-15(24)14(6-12)23(27,28)29;22-13-3-1-10(7-16(13)36(27,28,29,30)31)15-9-35-17(8-33-15)34-20(21(24,25)26)19(35)12-2-4-14-11(18(12)23)5-6-32-14;1-11-21(14-3-5-16-13(20(14)23)6-7-29-16)32-10-17(30-9-19(32)31-11)12-2-4-15(22)18(8-12)33(24,25,26,27)28/h4-12H,1-3H3,(H,30,32);4-13H,1-3H3,(H,29,31);2-9H,1H3,(H,34,36);4-11H,2-3H2,1H3,(H,33,34);1-9,32H;2-10,29H,1H3.
What are the key properties of [4-[2-cyclopropyl-6-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-3,5-difluorophenoxy]-methylphosphinic acid;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(1,1,2,2,2-pentafluoroethyl)phenyl]imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane?
[4-[2-cyclopropyl-6-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-3,5-difluorophenoxy]-methylphosphinic acid;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(1,1,2,2,2-pentafluoroethyl)phenyl]imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane has a molecular weight of 2972.42 g/mol, XLogP of 42.61, 23 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-cyclopropyl-6-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-3-yl]-3,5-difluorophenoxy]-methylphosphinic acid;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-[4-fluoro-3-(1,1,2,2,2-pentafluoroethyl)phenyl]imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(4-fluoro-3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;2-(1,1-difluoroethyl)-3-(4-fluoro-1H-indazol-5-yl)-6-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrazine;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-methylimidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane;pentafluoro-[2-fluoro-5-[3-(4-fluoro-1H-indol-5-yl)-2-(trifluoromethyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]-λ6-sulfane is sourced from PubChem (CID 158280699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).