7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole

C140H157BrClF11N16O6 — CID 159043544

IUPAC7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole
SMILESC.COc1c(F)ccc(F)c1C.COc1cc(F)cc(F)c1C.COc1ccc(F)c(F)c1C.COc1ccc2ccccc2c1C.COc1cccc(C)c1C.COc1cccc(F)c1C.Cc1c(F)ccc2c1cnn2C.Cc1cc2cnn(C)c2c(C)c1C.Cc1ccc2c(C)nn(C)c2c1C.Cc1ccc2c(c(F)nn2C)c1C.Cc1ccc2cnn(C)c2c1C.Cc1cccc(Cl)c1C.Cc1cccc2c1cnn2C.Cc1nn(C)c2c(C)c(F)ccc12.Cn1ncc2ccc(F)c(Br)c21
InChIInChI=1S/C12H12O.2C11H14N2.2C10H11FN2.C10H12N2.C9H9FN2.C9H10N2.C9H12O.C8H6BrFN2.C8H9Cl.3C8H8F2O.C8H9FO.CH4/c1-9-11-6-4-3-5-10(11)7-8-12(9)13-2;1-7-5-10-6-12-13(4)11(10)9(3)8(7)2;1-7-5-6-10-9(3)12-13(4)11(10)8(7)2;1-6-9(11)5-4-8-7(2)12-13(3)10(6)8;1-6-4-5-8-9(7(6)2)10(11)12-13(8)3;1-7-4-5-9-6-11-12(3)10(9)8(7)2;1-6-7-5-11-12(2)9(7)4-3-8(6)10;1-7-4-3-5-9-8(7)6-10-11(9)2;1-7-5-4-6-9(10-3)8(7)2;1-12-8-5(4-11-12)2-3-6(10)7(8)9;1-6-4-3-5-8(9)7(6)2;1-5-7(10)3-6(9)4-8(5)11-2;1-5-7(11-2)4-3-6(9)8(5)10;1-5-6(9)3-4-7(10)8(5)11-2;1-6-7(9)4-3-5-8(6)10-2;/h3-8H,1-2H3;2*5-6H,1-4H3;2*4-5H,1-3H3;4-6H,1-3H3;3-5H,1-2H3;3-6H,1-2H3;4-6H,1-3H3;2-4H,1H3;3-5H,1-2H3;3*3-4H,1-2H3;3-5H,1-2H3;1H4
InChIKeyJWJIKFQWLQAJAE-UHFFFAOYSA-N
MW2484.24 g/mol
LogP36.27
Rot. Bonds6

About 7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole

7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole (PubChem CID 159043544) has the molecular formula C140H157BrClF11N16O6 and a molecular weight of 2484.24 g/mol. Its IUPAC name is 7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole.

Molecular Properties

Compound Name7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole
PubChem CID159043544
Molecular FormulaC140H157BrClF11N16O6
Molecular Weight2484.24 g/mol
Exact Mass2481.12
IUPAC Name7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole
SMILESC.COc1c(F)ccc(F)c1C.COc1cc(F)cc(F)c1C.COc1ccc(F)c(F)c1C.COc1ccc2ccccc2c1C.COc1cccc(C)c1C.COc1cccc(F)c1C.Cc1c(F)ccc2c1cnn2C.Cc1cc2cnn(C)c2c(C)c1C.Cc1ccc2c(C)nn(C)c2c1C.Cc1ccc2c(c(F)nn2C)c1C.Cc1ccc2cnn(C)c2c1C.Cc1cccc(Cl)c1C.Cc1cccc2c1cnn2C.Cc1nn(C)c2c(C)c(F)ccc12.Cn1ncc2ccc(F)c(Br)c21
InChIInChI=1S/C12H12O.2C11H14N2.2C10H11FN2.C10H12N2.C9H9FN2.C9H10N2.C9H12O.C8H6BrFN2.C8H9Cl.3C8H8F2O.C8H9FO.CH4/c1-9-11-6-4-3-5-10(11)7-8-12(9)13-2;1-7-5-10-6-12-13(4)11(10)9(3)8(7)2;1-7-5-6-10-9(3)12-13(4)11(10)8(7)2;1-6-9(11)5-4-8-7(2)12-13(3)10(6)8;1-6-4-5-8-9(7(6)2)10(11)12-13(8)3;1-7-4-5-9-6-11-12(3)10(9)8(7)2;1-6-7-5-11-12(2)9(7)4-3-8(6)10;1-7-4-3-5-9-8(7)6-10-11(9)2;1-7-5-4-6-9(10-3)8(7)2;1-12-8-5(4-11-12)2-3-6(10)7(8)9;1-6-4-3-5-8(9)7(6)2;1-5-7(10)3-6(9)4-8(5)11-2;1-5-7(11-2)4-3-6(9)8(5)10;1-5-6(9)3-4-7(10)8(5)11-2;1-6-7(9)4-3-5-8(6)10-2;/h3-8H,1-2H3;2*5-6H,1-4H3;2*4-5H,1-3H3;4-6H,1-3H3;3-5H,1-2H3;3-6H,1-2H3;4-6H,1-3H3;2-4H,1H3;3-5H,1-2H3;3*3-4H,1-2H3;3-5H,1-2H3;1H4
InChIKeyJWJIKFQWLQAJAE-UHFFFAOYSA-N
XLogP36.27
TPSA197.94 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds6
Heavy Atoms175
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002484.24
LogP ≤ 536.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze 7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole with MolForge

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Related Compounds

7-Bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,5,6,7-tetramethylindazole;1,3,7-trimethylindazole;1,4,5-trimethylindazole;1,6,7-trimethylindazole
CID 159748291
1-benzyl-4-tert-butyl-3-methylpyrazole;1-benzyl-4-tert-butylpyrazole;tert-butylbenzene;1-tert-butyl-2-chlorobenzene;1-tert-butyl-3-chlorobenzene;1-tert-butyl-4-chlorobenzene;3-tert-butyl-1-chloro-2,4-difluorobenzene;1-tert-butyl-3-chloro-2-fluorobenzene;2-tert-butyl-4-chloro-1-fluorobenzene;2-tert-butyl-1,3-difluorobenzene;1-tert-butyl-2-fluoro-3-methylbenzene;1-tert-butyl-2-methoxybenzene;1-tert-butyl-3-methoxybenzene;1-tert-butyl-4-methoxybenzene;1-tert-butyl-2-methylbenzene;4-tert-butyl-3-methyl-1-phenylpyrazole;2-tert-butylnaphthalene;7-tert-butyl-5-phenyl-1H-indole;4-tert-butyl-1-phenylpyrazole
CID 167676823

Frequently Asked Questions

What is the IUPAC name of 7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole?
The IUPAC name of 7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole (CID 159043544) is 7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole.
What is the SMILES notation for 7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole?
The canonical SMILES for 7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole is C.COc1c(F)ccc(F)c1C.COc1cc(F)cc(F)c1C.COc1ccc(F)c(F)c1C.COc1ccc2ccccc2c1C.COc1cccc(C)c1C.COc1cccc(F)c1C.Cc1c(F)ccc2c1cnn2C.Cc1cc2cnn(C)c2c(C)c1C.Cc1ccc2c(C)nn(C)c2c1C.Cc1ccc2c(c(F)nn2C)c1C.Cc1ccc2cnn(C)c2c1C.Cc1cccc(Cl)c1C.Cc1cccc2c1cnn2C.Cc1nn(C)c2c(C)c(F)ccc12.Cn1ncc2ccc(F)c(Br)c21.
What is the InChIKey of 7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole?
The InChIKey is JWJIKFQWLQAJAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O.2C11H14N2.2C10H11FN2.C10H12N2.C9H9FN2.C9H10N2.C9H12O.C8H6BrFN2.C8H9Cl.3C8H8F2O.C8H9FO.CH4/c1-9-11-6-4-3-5-10(11)7-8-12(9)13-2;1-7-5-10-6-12-13(4)11(10)9(3)8(7)2;1-7-5-6-10-9(3)12-13(4)11(10)8(7)2;1-6-9(11)5-4-8-7(2)12-13(3)10(6)8;1-6-4-5-8-9(7(6)2)10(11)12-13(8)3;1-7-4-5-9-6-11-12(3)10(9)8(7)2;1-6-7-5-11-12(2)9(7)4-3-8(6)10;1-7-4-3-5-9-8(7)6-10-11(9)2;1-7-5-4-6-9(10-3)8(7)2;1-12-8-5(4-11-12)2-3-6(10)7(8)9;1-6-4-3-5-8(9)7(6)2;1-5-7(10)3-6(9)4-8(5)11-2;1-5-7(11-2)4-3-6(9)8(5)10;1-5-6(9)3-4-7(10)8(5)11-2;1-6-7(9)4-3-5-8(6)10-2;/h3-8H,1-2H3;2*5-6H,1-4H3;2*4-5H,1-3H3;4-6H,1-3H3;3-5H,1-2H3;3-6H,1-2H3;4-6H,1-3H3;2-4H,1H3;3-5H,1-2H3;3*3-4H,1-2H3;3-5H,1-2H3;1H4.
What are the key properties of 7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole?
7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole has a molecular weight of 2484.24 g/mol, XLogP of 36.27, 6 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-6-fluoro-1-methylindazole;1-chloro-2,3-dimethylbenzene;1,2-difluoro-4-methoxy-3-methylbenzene;1,4-difluoro-2-methoxy-3-methylbenzene;1,5-difluoro-3-methoxy-2-methylbenzene;1,4-dimethylindazole;5-fluoro-1,4-dimethylindazole;1-fluoro-3-methoxy-2-methylbenzene;3-fluoro-1,4,5-trimethylindazole;6-fluoro-1,3,7-trimethylindazole;methane;1-methoxy-2,3-dimethylbenzene;2-methoxy-1-methylnaphthalene;1,3,6,7-tetramethylindazole;1,5,6,7-tetramethylindazole;1,6,7-trimethylindazole is sourced from PubChem (CID 159043544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).