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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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

C268H411N27O10S5Si3 — CID 158297989

IUPAC1,1-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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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
SMILESC.C.C.C.C.C.C.C.C.C.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)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)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)c2nsnc12.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.C14H18O2.C14H18S.C13H18N2.C13H17NO.2C13H20.C12H18N2O.C12H16N2O.2C12H18N2O.C12H16N2S.C11H16N4.C11H15N3O.C11H15N3S.C10H14N4S.10CH4/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)7-16-14(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;1-8(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;1-7(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;5-10H,1-4H3;5-9,14H,1-4H3;5-9H,1-4H3;2*6-10H,1-5H3;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;10*1H4
InChIKeyGMDLEYDJFWJXPZ-UHFFFAOYSA-N
MW4416.01 g/mol
LogP79.77
Rot. Bonds42

About 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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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

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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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 (PubChem CID 158297989) has the molecular formula C268H411N27O10S5Si3 and a molecular weight of 4416.01 g/mol. Its IUPAC name is 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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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.

Molecular Properties

Compound Name1,1-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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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
PubChem CID158297989
Molecular FormulaC268H411N27O10S5Si3
Molecular Weight4416.01 g/mol
Exact Mass4412.04
IUPAC Name1,1-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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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
SMILESC.C.C.C.C.C.C.C.C.C.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)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)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)c2nsnc12.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.C14H18O2.C14H18S.C13H18N2.C13H17NO.2C13H20.C12H18N2O.C12H16N2O.2C12H18N2O.C12H16N2S.C11H16N4.C11H15N3O.C11H15N3S.C10H14N4S.10CH4/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)7-16-14(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;1-8(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;1-7(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;5-10H,1-4H3;5-9,14H,1-4H3;5-9H,1-4H3;2*6-10H,1-5H3;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;10*1H4
InChIKeyGMDLEYDJFWJXPZ-UHFFFAOYSA-N
XLogP79.77
TPSA461.74 Ų
H-Bond Donors1
H-Bond Acceptors41
Rotatable Bonds42
Heavy Atoms313
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004416.01
LogP ≤ 579.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1041

Analyze 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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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 with MolForge

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Related Compounds

2,2-difluoro-4,7-di(propan-2-yl)-1,3-benzodioxole;4,7-di(propan-2-yl)-1,3-benzodioxole;1,4-di(propan-2-yl)-5H-cyclopenta[c]pyridine;4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-c]pyridine;4,7-di(propan-2-yl)-2,3-dihydrofuro[3,2-c]pyridine;bis(4,7-di(propan-2-yl)-2,3-dihydrofuro[2,3-d]pyridazine);4,7-di(propan-2-yl)furo[3,2-c]pyridine;4,7-di(propan-2-yl)-1H-indene;4,7-di(propan-2-yl)-[1,3]oxazolo[5,4-c]pyridine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-d]pyridazine;2,5-di(propan-2-yl)pyrazine;bis(2,5-di(propan-2-yl)pyridine);4,7-di(propan-2-yl)-[1,3]thiazolo[5,4-c]pyridine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-d]pyridazine;bis(3-methoxy-2,5-di(propan-2-yl)pyrazine);3-methoxy-2,5-di(propan-2-yl)pyridine
CID 158166847
CID 158294602
CID 158294602
2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,4-di(propan-2-yl)benzene;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;1,4-di(propan-2-yl)-6,7-dihydrocyclopenta[c]pyridin-5-one;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine;4,7-di(propan-2-yl)furo[2,3-c]pyridine;4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridin-3-one;bis(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)-[1,3]oxazolo[4,5-c]pyridine;[2,5-di(propan-2-yl)phenyl]methanol;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;[3,6-di(propan-2-yl)-2-pyridinyl]methanol;4,7-di(propan-2-yl)-1H-pyrrolo[2,3-c]pyridine;4,7-di(propan-2-yl)-[1,2,5]thiadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]thiazolo[4,5-c]pyridine;2-fluoro-1,4-di(propan-2-yl)benzene;2-fluoro-2-methyl-4,7-di(propan-2-yl)-3H-1-benzofuran;methane;bis(2-methyl-1,4-di(propan-2-yl)benzene)
CID 159004141
CID 160247909
CID 160247909
CID 160677969
CID 160677969
2,2-difluoro-4,7-di(propan-2-yl)-3H-1-benzofuran;1,4-di(propan-2-yl)benzene;4,7-di(propan-2-yl)-3H-2-benzofuran-1-one;1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-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)-[1,2,5]oxadiazolo[3,4-d]pyridazine;4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;[2,5-di(propan-2-yl)phenyl]methanol;[2,5-di(propan-2-yl)phenyl]methyl-dimethylsilane;2,5-di(propan-2-yl)pyridine;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;2-fluoro-1,4-di(propan-2-yl)benzene;methane;3-methoxy-2,5-di(propan-2-yl)pyridine;tris(2-methyl-1,4-di(propan-2-yl)benzene);3-methylidene-4,7-di(propan-2-yl)-1H-furo[3,4-c]pyridine
CID 160801683
CID 161013949
CID 161013949
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;1,4-di(propan-2-yl)benzene;4,7-di(propan-2-yl)-1-benzothiophene;1,4-di(propan-2-yl)-5,6-dihydrocyclopenta[c]pyridin-7-one;1,4-di(propan-2-yl)-6,7-dihydrocyclopenta[c]pyridin-5-one;1,4-di(propan-2-yl)-6,7-dihydro-5H-cyclopenta[d]pyridazine;1,4-di(propan-2-yl)-6,7-dihydrocyclopenta[d]pyridazin-5-one;4,7-di(propan-2-yl)-2,3-dihydroinden-1-one;4,7-di(propan-2-yl)furo[2,3-c]pyridine;bis(4,7-di(propan-2-yl)-2H-imidazo[4,5-d]pyridazine);4,7-di(propan-2-yl)-[1,3]oxazolo[4,5-c]pyridine;[2,5-di(propan-2-yl)phenyl]methanol;[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;2-fluoro-1,4-di(propan-2-yl)benzene;tris(2-methyl-1,4-di(propan-2-yl)benzene)
CID 161070998
CID 161279329
CID 161279329
CID 161472059
CID 161472059
CID 161666972
CID 161666972
2,3-Ditert-butyl-1-benzofuran;4,5-ditert-butyl-2,1-benzothiazole;5,6-ditert-butyl-1,2-benzothiazole;5,6-ditert-butyl-1,3-benzothiazole;2,3-ditert-butyl-1-benzothiophene;4,5-ditert-butyl-1,2-benzoxazole;5,6-ditert-butyl-1,3-benzoxazole;5,6-ditert-butyl-2,1-benzoxazole;2,3-ditert-butylfuro[3,4-b]pyridine;5,6-ditert-butylfuro[2,3-b]pyridine;5,6-ditert-butylfuro[3,2-b]pyridine;4,5-ditert-butylfuro[2,3-c]pyridine;6,7-ditert-butylfuro[3,4-c]pyridine;6,7-ditert-butylpyrazolo[1,5-a]pyrazine;4,5-ditert-butylthieno[2,3-b]pyridine;6,7-ditert-butylthieno[3,2-b]pyridine;4,5-ditert-butylthieno[2,3-c]pyridine;5,6-ditert-butyltriazolo[1,5-a]pyridine
CID 157057682

Frequently Asked Questions

What is the IUPAC name of 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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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?
The IUPAC name of 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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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 (CID 158297989) is 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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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.
What is the SMILES notation for 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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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?
The canonical SMILES for 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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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 is C.C.C.C.C.C.C.C.C.C.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)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)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)c2nsnc12.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 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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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?
The InChIKey is GMDLEYDJFWJXPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H24OSi.C15H20S.C15H26Si.C15H20.C14H18O2.C14H18S.C13H18N2.C13H17NO.2C13H20.C12H18N2O.C12H16N2O.2C12H18N2O.C12H16N2S.C11H16N4.C11H15N3O.C11H15N3S.C10H14N4S.10CH4/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)7-16-14(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;1-8(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;1-7(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;5-10H,1-4H3;5-9,14H,1-4H3;5-9H,1-4H3;2*6-10H,1-5H3;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;10*1H4.
What are the key properties of 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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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?
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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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 has a molecular weight of 4416.01 g/mol, XLogP of 79.77, 42 rotatable bonds, 1 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 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)-2H-imidazo[4,5-d]pyridazine;4,7-di(propan-2-yl)-1H-indene;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)-[1,2,5]thiadiazolo[3,4-d]pyridazine;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 is sourced from PubChem (CID 158297989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).