2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine

C329H513F2N31O17S4Si3 — CID 161472059

IUPAC2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C=C1OCc2c(C(C)C)cnc(C(C)C)c21.CC(C)c1ccc(C(C)C)c(C[SiH](C)C)c1.CC(C)c1ccc(C(C)C)c2c1C=CC2.CC(C)c1ccc(C(C)C)c2c1CC(F)(F)O2.CC(C)c1ccc(C(C)C)c2c1COC2=O.CC(C)c1ccc(C(C)C)c2c1CO[Si]2(C)C.CC(C)c1ccc(C(C)C)c2c1C[Si](C)(C)O2.CC(C)c1ccc(C(C)C)c2sccc12.CC(C)c1cnc(C(C)C)c2[nH]ccc12.CC(C)c1cnc(C(C)C)c2c1C(=O)OC2.CC(C)c1cnc(C(C)C)c2occc12.CC(C)c1ncc(C(C)C)c2ocnc12.CC(C)c1ncc(C(C)C)c2scnc12.CC(C)c1nnc(C(C)C)c2c1=NCN=2.CC(C)c1nnc(C(C)C)c2c1CCO2.CC(C)c1nnc(C(C)C)c2c1CCO2.CC(C)c1nnc(C(C)C)c2c1COC2.CC(C)c1nnc(C(C)C)c2c1COC2=O.CC(C)c1nnc(C(C)C)c2nonc12.CC(C)c1nnc(C(C)C)c2ocnc12.CC(C)c1nnc(C(C)C)c2scnc12.Cc1cc(C(C)C)ccc1C(C)C.Cc1cc(C(C)C)ccc1C(C)C.Cc1csc2c(C(C)C)ccc(C(C)C)c12
InChIInChI=1S/2C15H24OSi.C15H20S.C15H26Si.C15H20.C14H18F2O.C14H19NO.C14H18O2.C14H18S.C13H18N2.C13H17NO2.C13H17NO.2C13H20.C12H16N2O2.C12H18N2O.C12H16N2O.2C12H18N2O.C12H16N2S.C11H16N4.C11H15N3O.C11H15N3S.C10H14N4O.18CH4/c1-10(2)12-7-8-13(11(3)4)15-14(12)9-17(5,6)16-15;1-10(2)12-7-8-13(11(3)4)15-14(12)9-16-17(15,5)6;1-9(2)12-6-7-13(10(3)4)15-14(12)11(5)8-16-15;1-11(2)13-7-8-15(12(3)4)14(9-13)10-16(5)6;1-10(2)12-8-9-13(11(3)4)15-7-5-6-14(12)15;1-8(2)10-5-6-11(9(3)4)13-12(10)7-14(15,16)17-13;1-8(2)11-6-15-14(9(3)4)13-10(5)16-7-12(11)13;1-8(2)10-5-6-11(9(3)4)13-12(10)7-16-14(13)15;1-9(2)11-5-6-12(10(3)4)14-13(11)7-8-15-14;1-8(2)11-7-15-12(9(3)4)13-10(11)5-6-14-13;1-7(2)9-5-14-12(8(3)4)10-6-16-13(15)11(9)10;1-8(2)11-7-14-12(9(3)4)13-10(11)5-6-15-13;2*1-9(2)12-6-7-13(10(3)4)11(5)8-12;1-6(2)10-8-5-16-12(15)9(8)11(7(3)4)14-13-10;1-7(2)11-9-5-15-6-10(9)12(8(3)4)14-13-11;1-7(2)9-5-13-10(8(3)4)11-12(9)15-6-14-11;2*1-7(2)10-9-5-6-15-12(9)11(8(3)4)14-13-10;1-7(2)9-5-13-10(8(3)4)11-12(9)15-6-14-11;1-6(2)8-10-11(13-5-12-10)9(7(3)4)15-14-8;2*1-6(2)8-10-11(15-5-12-10)9(7(3)4)14-13-8;1-5(2)7-9-10(14-15-13-9)8(6(3)4)12-11-7;;;;;;;;;;;;;;;;;;/h2*7-8,10-11H,9H2,1-6H3;6-10H,1-5H3;7-9,11-12,16H,10H2,1-6H3;5-6,8-11H,7H2,1-4H3;5-6,8-9H,7H2,1-4H3;6,8-9H,5,7H2,1-4H3;5-6,8-9H,7H2,1-4H3;5-10H,1-4H3;5-9,14H,1-4H3;5,7-8H,6H2,1-4H3;5-9H,1-4H3;2*6-10H,1-5H3;6-7H,5H2,1-4H3;7-8H,5-6H2,1-4H3;5-8H,1-4H3;2*7-8H,5-6H2,1-4H3;5-8H,1-4H3;6-7H,5H2,1-4H3;2*5-7H,1-4H3;5-6H,1-4H3;18*1H4
InChIKeyWDFKROSCIKKDNY-UHFFFAOYSA-N
MW5425.45 g/mol
LogP98.07
Rot. Bonds50

About 2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine

2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine (PubChem CID 161472059) has the molecular formula C329H513F2N31O17S4Si3 and a molecular weight of 5425.45 g/mol. Its IUPAC name is 2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine.

Molecular Properties

Compound Name2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine
PubChem CID161472059
Molecular FormulaC329H513F2N31O17S4Si3
Molecular Weight5425.45 g/mol
Exact Mass5420.84
IUPAC Name2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C=C1OCc2c(C(C)C)cnc(C(C)C)c21.CC(C)c1ccc(C(C)C)c(C[SiH](C)C)c1.CC(C)c1ccc(C(C)C)c2c1C=CC2.CC(C)c1ccc(C(C)C)c2c1CC(F)(F)O2.CC(C)c1ccc(C(C)C)c2c1COC2=O.CC(C)c1ccc(C(C)C)c2c1CO[Si]2(C)C.CC(C)c1ccc(C(C)C)c2c1C[Si](C)(C)O2.CC(C)c1ccc(C(C)C)c2sccc12.CC(C)c1cnc(C(C)C)c2[nH]ccc12.CC(C)c1cnc(C(C)C)c2c1C(=O)OC2.CC(C)c1cnc(C(C)C)c2occc12.CC(C)c1ncc(C(C)C)c2ocnc12.CC(C)c1ncc(C(C)C)c2scnc12.CC(C)c1nnc(C(C)C)c2c1=NCN=2.CC(C)c1nnc(C(C)C)c2c1CCO2.CC(C)c1nnc(C(C)C)c2c1CCO2.CC(C)c1nnc(C(C)C)c2c1COC2.CC(C)c1nnc(C(C)C)c2c1COC2=O.CC(C)c1nnc(C(C)C)c2nonc12.CC(C)c1nnc(C(C)C)c2ocnc12.CC(C)c1nnc(C(C)C)c2scnc12.Cc1cc(C(C)C)ccc1C(C)C.Cc1cc(C(C)C)ccc1C(C)C.Cc1csc2c(C(C)C)ccc(C(C)C)c12
InChIInChI=1S/2C15H24OSi.C15H20S.C15H26Si.C15H20.C14H18F2O.C14H19NO.C14H18O2.C14H18S.C13H18N2.C13H17NO2.C13H17NO.2C13H20.C12H16N2O2.C12H18N2O.C12H16N2O.2C12H18N2O.C12H16N2S.C11H16N4.C11H15N3O.C11H15N3S.C10H14N4O.18CH4/c1-10(2)12-7-8-13(11(3)4)15-14(12)9-17(5,6)16-15;1-10(2)12-7-8-13(11(3)4)15-14(12)9-16-17(15,5)6;1-9(2)12-6-7-13(10(3)4)15-14(12)11(5)8-16-15;1-11(2)13-7-8-15(12(3)4)14(9-13)10-16(5)6;1-10(2)12-8-9-13(11(3)4)15-7-5-6-14(12)15;1-8(2)10-5-6-11(9(3)4)13-12(10)7-14(15,16)17-13;1-8(2)11-6-15-14(9(3)4)13-10(5)16-7-12(11)13;1-8(2)10-5-6-11(9(3)4)13-12(10)7-16-14(13)15;1-9(2)11-5-6-12(10(3)4)14-13(11)7-8-15-14;1-8(2)11-7-15-12(9(3)4)13-10(11)5-6-14-13;1-7(2)9-5-14-12(8(3)4)10-6-16-13(15)11(9)10;1-8(2)11-7-14-12(9(3)4)13-10(11)5-6-15-13;2*1-9(2)12-6-7-13(10(3)4)11(5)8-12;1-6(2)10-8-5-16-12(15)9(8)11(7(3)4)14-13-10;1-7(2)11-9-5-15-6-10(9)12(8(3)4)14-13-11;1-7(2)9-5-13-10(8(3)4)11-12(9)15-6-14-11;2*1-7(2)10-9-5-6-15-12(9)11(8(3)4)14-13-10;1-7(2)9-5-13-10(8(3)4)11-12(9)15-6-14-11;1-6(2)8-10-11(13-5-12-10)9(7(3)4)15-14-8;2*1-6(2)8-10-11(15-5-12-10)9(7(3)4)14-13-8;1-5(2)7-9-10(14-15-13-9)8(6(3)4)12-11-7;;;;;;;;;;;;;;;;;;/h2*7-8,10-11H,9H2,1-6H3;6-10H,1-5H3;7-9,11-12,16H,10H2,1-6H3;5-6,8-11H,7H2,1-4H3;5-6,8-9H,7H2,1-4H3;6,8-9H,5,7H2,1-4H3;5-6,8-9H,7H2,1-4H3;5-10H,1-4H3;5-9,14H,1-4H3;5,7-8H,6H2,1-4H3;5-9H,1-4H3;2*6-10H,1-5H3;6-7H,5H2,1-4H3;7-8H,5-6H2,1-4H3;5-8H,1-4H3;2*7-8H,5-6H2,1-4H3;5-8H,1-4H3;6-7H,5H2,1-4H3;2*5-7H,1-4H3;5-6H,1-4H3;18*1H4
InChIKeyWDFKROSCIKKDNY-UHFFFAOYSA-N
XLogP98.07
TPSA597.50 Ų
H-Bond Donors1
H-Bond Acceptors51
Rotatable Bonds50
Heavy Atoms386
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005425.45
LogP ≤ 598.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1051

Analyze 2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine?
The IUPAC name of 2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine (CID 161472059) is 2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine.
What is the SMILES notation for 2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine?
The canonical SMILES for 2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C=C1OCc2c(C(C)C)cnc(C(C)C)c21.CC(C)c1ccc(C(C)C)c(C[SiH](C)C)c1.CC(C)c1ccc(C(C)C)c2c1C=CC2.CC(C)c1ccc(C(C)C)c2c1CC(F)(F)O2.CC(C)c1ccc(C(C)C)c2c1COC2=O.CC(C)c1ccc(C(C)C)c2c1CO[Si]2(C)C.CC(C)c1ccc(C(C)C)c2c1C[Si](C)(C)O2.CC(C)c1ccc(C(C)C)c2sccc12.CC(C)c1cnc(C(C)C)c2[nH]ccc12.CC(C)c1cnc(C(C)C)c2c1C(=O)OC2.CC(C)c1cnc(C(C)C)c2occc12.CC(C)c1ncc(C(C)C)c2ocnc12.CC(C)c1ncc(C(C)C)c2scnc12.CC(C)c1nnc(C(C)C)c2c1=NCN=2.CC(C)c1nnc(C(C)C)c2c1CCO2.CC(C)c1nnc(C(C)C)c2c1CCO2.CC(C)c1nnc(C(C)C)c2c1COC2.CC(C)c1nnc(C(C)C)c2c1COC2=O.CC(C)c1nnc(C(C)C)c2nonc12.CC(C)c1nnc(C(C)C)c2ocnc12.CC(C)c1nnc(C(C)C)c2scnc12.Cc1cc(C(C)C)ccc1C(C)C.Cc1cc(C(C)C)ccc1C(C)C.Cc1csc2c(C(C)C)ccc(C(C)C)c12.
What is the InChIKey of 2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine?
The InChIKey is WDFKROSCIKKDNY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H24OSi.C15H20S.C15H26Si.C15H20.C14H18F2O.C14H19NO.C14H18O2.C14H18S.C13H18N2.C13H17NO2.C13H17NO.2C13H20.C12H16N2O2.C12H18N2O.C12H16N2O.2C12H18N2O.C12H16N2S.C11H16N4.C11H15N3O.C11H15N3S.C10H14N4O.18CH4/c1-10(2)12-7-8-13(11(3)4)15-14(12)9-17(5,6)16-15;1-10(2)12-7-8-13(11(3)4)15-14(12)9-16-17(15,5)6;1-9(2)12-6-7-13(10(3)4)15-14(12)11(5)8-16-15;1-11(2)13-7-8-15(12(3)4)14(9-13)10-16(5)6;1-10(2)12-8-9-13(11(3)4)15-7-5-6-14(12)15;1-8(2)10-5-6-11(9(3)4)13-12(10)7-14(15,16)17-13;1-8(2)11-6-15-14(9(3)4)13-10(5)16-7-12(11)13;1-8(2)10-5-6-11(9(3)4)13-12(10)7-16-14(13)15;1-9(2)11-5-6-12(10(3)4)14-13(11)7-8-15-14;1-8(2)11-7-15-12(9(3)4)13-10(11)5-6-14-13;1-7(2)9-5-14-12(8(3)4)10-6-16-13(15)11(9)10;1-8(2)11-7-14-12(9(3)4)13-10(11)5-6-15-13;2*1-9(2)12-6-7-13(10(3)4)11(5)8-12;1-6(2)10-8-5-16-12(15)9(8)11(7(3)4)14-13-10;1-7(2)11-9-5-15-6-10(9)12(8(3)4)14-13-11;1-7(2)9-5-13-10(8(3)4)11-12(9)15-6-14-11;2*1-7(2)10-9-5-6-15-12(9)11(8(3)4)14-13-10;1-7(2)9-5-13-10(8(3)4)11-12(9)15-6-14-11;1-6(2)8-10-11(13-5-12-10)9(7(3)4)15-14-8;2*1-6(2)8-10-11(15-5-12-10)9(7(3)4)14-13-8;1-5(2)7-9-10(14-15-13-9)8(6(3)4)12-11-7;;;;;;;;;;;;;;;;;;/h2*7-8,10-11H,9H2,1-6H3;6-10H,1-5H3;7-9,11-12,16H,10H2,1-6H3;5-6,8-11H,7H2,1-4H3;5-6,8-9H,7H2,1-4H3;6,8-9H,5,7H2,1-4H3;5-6,8-9H,7H2,1-4H3;5-10H,1-4H3;5-9,14H,1-4H3;5,7-8H,6H2,1-4H3;5-9H,1-4H3;2*6-10H,1-5H3;6-7H,5H2,1-4H3;7-8H,5-6H2,1-4H3;5-8H,1-4H3;2*7-8H,5-6H2,1-4H3;5-8H,1-4H3;6-7H,5H2,1-4H3;2*5-7H,1-4H3;5-6H,1-4H3;18*1H4.
What are the key properties of 2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine?
2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine has a molecular weight of 5425.45 g/mol, XLogP of 98.07, 50 rotatable bonds, 1 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,1-dimethyl-4,7-di(propan-2-yl)-3H-2,1-benzoxasilole;2,2-dimethyl-4,7-di(propan-2-yl)-3H-1,2-benzoxasilole;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-3H-furo[3,4-c]pyridin-1-one;1,4-di(propan-2-yl)-7H-furo[3,4-d]pyridazin-5-one;4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene);3-methyl-4,7-di(propan-2-yl)-1-benzothiophene;3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine is sourced from PubChem (CID 161472059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).