4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol

C226H289Cl2F4IN38O6 — CID 167689654

IUPAC4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol
SMILESCC(C)(C)c1[nH]nc2ccccc12.CC(C)(C)c1c(Cl)ccc2[nH]ncc12.CC(C)(C)c1cc(O)cc2ccccc12.CNc1n[nH]c2ccc(C)c(C(C)(C)C)c12.COc1cc(C(C)(C)C)c2ccccc2c1.Cc1cc(F)c2[nH]nc(N)c2c1C(C)(C)C.Cc1cc(F)c2n[nH]c(F)c2c1C(C)(C)C.Cc1ccc2[nH][nH]c(=O)c2c1C(C)(C)C.Cc1ccc2[nH]nc(C#N)c2c1C(C)(C)C.Cc1ccc2[nH]nc(C(N)=O)c2c1C(C)(C)C.Cc1ccc2[nH]nc(N)c2c1C(C)(C)C.Cc1ccc2[nH]ncc2c1C(C)(C)C.Cc1ccc2n[nH]c(C)c2c1C(C)(C)C.Cc1ccc2n[nH]c(C3CC3)c2c1C(C)(C)C.Cc1ccc2n[nH]c(Cl)c2c1C(C)(C)C.Cc1ccc2n[nH]c(F)c2c1C(C)(C)C.Cc1ccc2n[nH]c(I)c2c1C(C)(C)C.Cc1ccc2n[nH]c([N+](=O)[O-])c2c1C(C)(C)C
InChIInChI=1S/C15H20N2.C15H18O.C14H16O.C13H17N3O.C13H19N3.C13H15N3.C13H18N2.C12H15ClN2.C12H14F2N2.C12H16FN3.C12H15FN2.C12H15IN2.C12H15N3O2.C12H17N3.C12H16N2O.C12H16N2.C11H13ClN2.C11H14N2/c1-9-5-8-11-12(13(9)15(2,3)4)14(17-16-11)10-6-7-10;1-15(2,3)14-10-12(16-4)9-11-7-5-6-8-13(11)14;1-14(2,3)13-9-11(15)8-10-6-4-5-7-12(10)13;1-7-5-6-8-9(10(7)13(2,3)4)11(12(14)17)16-15-8;1-8-6-7-9-10(11(8)13(2,3)4)12(14-5)16-15-9;1-8-5-6-9-11(10(7-14)16-15-9)12(8)13(2,3)4;1-8-6-7-10-11(9(2)14-15-10)12(8)13(3,4)5;1-7-5-6-8-9(11(13)15-14-8)10(7)12(2,3)4;2*1-6-5-7(13)10-8(11(14)16-15-10)9(6)12(2,3)4;2*1-7-5-6-8-9(11(13)15-14-8)10(7)12(2,3)4;1-7-5-6-8-9(10(7)12(2,3)4)11(14-13-8)15(16)17;1-7-5-6-8-9(11(13)15-14-8)10(7)12(2,3)4;1-7-5-6-8-9(11(15)14-13-8)10(7)12(2,3)4;1-8-5-6-10-9(7-13-14-10)11(8)12(2,3)4;1-11(2,3)10-7-6-13-14-9(7)5-4-8(10)12;1-11(2,3)10-8-6-4-5-7-9(8)12-13-10/h5,8,10H,6-7H2,1-4H3,(H,16,17);5-10H,1-4H3;4-9,15H,1-3H3;5-6H,1-4H3,(H2,14,17)(H,15,16);6-7H,1-5H3,(H2,14,15,16);5-6H,1-4H3,(H,15,16);6-7H,1-5H3,(H,14,15);5-6H,1-4H3,(H,14,15);5H,1-4H3,(H,15,16);5H,1-4H3,(H3,14,15,16);2*5-6H,1-4H3,(H,14,15);5-6H,1-4H3,(H,13,14);5-6H,1-4H3,(H3,13,14,15);5-6H,1-4H3,(H2,13,14,15);5-7H,1-4H3,(H,13,14);4-6H,1-3H3,(H,13,14);4-7H,1-3H3,(H,12,13)
InChIKeyWSVLGEFAJQEBTF-UHFFFAOYSA-N
MW3907.86 g/mol
LogP59.10
Rot. Bonds5

About 4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol

4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol (PubChem CID 167689654) has the molecular formula C226H289Cl2F4IN38O6 and a molecular weight of 3907.86 g/mol. Its IUPAC name is 4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol.

Molecular Properties

Compound Name4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol
PubChem CID167689654
Molecular FormulaC226H289Cl2F4IN38O6
Molecular Weight3907.86 g/mol
Exact Mass3904.18
IUPAC Name4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol
SMILESCC(C)(C)c1[nH]nc2ccccc12.CC(C)(C)c1c(Cl)ccc2[nH]ncc12.CC(C)(C)c1cc(O)cc2ccccc12.CNc1n[nH]c2ccc(C)c(C(C)(C)C)c12.COc1cc(C(C)(C)C)c2ccccc2c1.Cc1cc(F)c2[nH]nc(N)c2c1C(C)(C)C.Cc1cc(F)c2n[nH]c(F)c2c1C(C)(C)C.Cc1ccc2[nH][nH]c(=O)c2c1C(C)(C)C.Cc1ccc2[nH]nc(C#N)c2c1C(C)(C)C.Cc1ccc2[nH]nc(C(N)=O)c2c1C(C)(C)C.Cc1ccc2[nH]nc(N)c2c1C(C)(C)C.Cc1ccc2[nH]ncc2c1C(C)(C)C.Cc1ccc2n[nH]c(C)c2c1C(C)(C)C.Cc1ccc2n[nH]c(C3CC3)c2c1C(C)(C)C.Cc1ccc2n[nH]c(Cl)c2c1C(C)(C)C.Cc1ccc2n[nH]c(F)c2c1C(C)(C)C.Cc1ccc2n[nH]c(I)c2c1C(C)(C)C.Cc1ccc2n[nH]c([N+](=O)[O-])c2c1C(C)(C)C
InChIInChI=1S/C15H20N2.C15H18O.C14H16O.C13H17N3O.C13H19N3.C13H15N3.C13H18N2.C12H15ClN2.C12H14F2N2.C12H16FN3.C12H15FN2.C12H15IN2.C12H15N3O2.C12H17N3.C12H16N2O.C12H16N2.C11H13ClN2.C11H14N2/c1-9-5-8-11-12(13(9)15(2,3)4)14(17-16-11)10-6-7-10;1-15(2,3)14-10-12(16-4)9-11-7-5-6-8-13(11)14;1-14(2,3)13-9-11(15)8-10-6-4-5-7-12(10)13;1-7-5-6-8-9(10(7)13(2,3)4)11(12(14)17)16-15-8;1-8-6-7-9-10(11(8)13(2,3)4)12(14-5)16-15-9;1-8-5-6-9-11(10(7-14)16-15-9)12(8)13(2,3)4;1-8-6-7-10-11(9(2)14-15-10)12(8)13(3,4)5;1-7-5-6-8-9(11(13)15-14-8)10(7)12(2,3)4;2*1-6-5-7(13)10-8(11(14)16-15-10)9(6)12(2,3)4;2*1-7-5-6-8-9(11(13)15-14-8)10(7)12(2,3)4;1-7-5-6-8-9(10(7)12(2,3)4)11(14-13-8)15(16)17;1-7-5-6-8-9(11(13)15-14-8)10(7)12(2,3)4;1-7-5-6-8-9(11(15)14-13-8)10(7)12(2,3)4;1-8-5-6-10-9(7-13-14-10)11(8)12(2,3)4;1-11(2,3)10-7-6-13-14-9(7)5-4-8(10)12;1-11(2,3)10-8-6-4-5-7-9(8)12-13-10/h5,8,10H,6-7H2,1-4H3,(H,16,17);5-10H,1-4H3;4-9,15H,1-3H3;5-6H,1-4H3,(H2,14,17)(H,15,16);6-7H,1-5H3,(H2,14,15,16);5-6H,1-4H3,(H,15,16);6-7H,1-5H3,(H,14,15);5-6H,1-4H3,(H,14,15);5H,1-4H3,(H,15,16);5H,1-4H3,(H3,14,15,16);2*5-6H,1-4H3,(H,14,15);5-6H,1-4H3,(H,13,14);5-6H,1-4H3,(H3,13,14,15);5-6H,1-4H3,(H2,13,14,15);5-7H,1-4H3,(H,13,14);4-6H,1-3H3,(H,13,14);4-7H,1-3H3,(H,12,13)
InChIKeyWSVLGEFAJQEBTF-UHFFFAOYSA-N
XLogP59.10
TPSA682.40 Ų
H-Bond Donors22
H-Bond Acceptors25
Rotatable Bonds5
Heavy Atoms277
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003907.86
LogP ≤ 559.10
H-Bond Donors ≤ 522
H-Bond Acceptors ≤ 1025

Analyze 4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol with MolForge

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Launch Full Analysis

Related Compounds

5-chloro-3-iodo-4-propan-2-yl-2H-indazole;3-chloro-5-methyl-4-propan-2-yl-2H-indazole;5-chloro-4-propan-2-yl-1H-indazole;1,3-difluoro-2-propan-2-ylbenzene;3,5-dimethyl-4-propan-2-yl-2H-indazole;2-methoxy-1-propan-2-ylnaphthalene;3-methoxy-1-propan-2-ylnaphthalene;5-methyl-3-nitro-4-propan-2-yl-2H-indazole;5-methyl-4-propan-2-yl-1H-indazol-3-amine;5-methyl-4-propan-2-yl-1H-indazole;5-methyl-4-propan-2-yl-1H-indazole-3-carbonitrile;5-methyl-4-propan-2-yl-1H-indazole-3-carboxamide;2-methyl-3-propan-2-ylnaphthalene;3-methyl-1-propan-2-ylnaphthalene;3-propan-2-yl-2H-indazole;4-propan-2-ylnaphthalen-2-ol
CID 167622900

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol?
The IUPAC name of 4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol (CID 167689654) is 4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol.
What is the SMILES notation for 4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol?
The canonical SMILES for 4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol is CC(C)(C)c1[nH]nc2ccccc12.CC(C)(C)c1c(Cl)ccc2[nH]ncc12.CC(C)(C)c1cc(O)cc2ccccc12.CNc1n[nH]c2ccc(C)c(C(C)(C)C)c12.COc1cc(C(C)(C)C)c2ccccc2c1.Cc1cc(F)c2[nH]nc(N)c2c1C(C)(C)C.Cc1cc(F)c2n[nH]c(F)c2c1C(C)(C)C.Cc1ccc2[nH][nH]c(=O)c2c1C(C)(C)C.Cc1ccc2[nH]nc(C#N)c2c1C(C)(C)C.Cc1ccc2[nH]nc(C(N)=O)c2c1C(C)(C)C.Cc1ccc2[nH]nc(N)c2c1C(C)(C)C.Cc1ccc2[nH]ncc2c1C(C)(C)C.Cc1ccc2n[nH]c(C)c2c1C(C)(C)C.Cc1ccc2n[nH]c(C3CC3)c2c1C(C)(C)C.Cc1ccc2n[nH]c(Cl)c2c1C(C)(C)C.Cc1ccc2n[nH]c(F)c2c1C(C)(C)C.Cc1ccc2n[nH]c(I)c2c1C(C)(C)C.Cc1ccc2n[nH]c([N+](=O)[O-])c2c1C(C)(C)C.
What is the InChIKey of 4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol?
The InChIKey is WSVLGEFAJQEBTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2.C15H18O.C14H16O.C13H17N3O.C13H19N3.C13H15N3.C13H18N2.C12H15ClN2.C12H14F2N2.C12H16FN3.C12H15FN2.C12H15IN2.C12H15N3O2.C12H17N3.C12H16N2O.C12H16N2.C11H13ClN2.C11H14N2/c1-9-5-8-11-12(13(9)15(2,3)4)14(17-16-11)10-6-7-10;1-15(2,3)14-10-12(16-4)9-11-7-5-6-8-13(11)14;1-14(2,3)13-9-11(15)8-10-6-4-5-7-12(10)13;1-7-5-6-8-9(10(7)13(2,3)4)11(12(14)17)16-15-8;1-8-6-7-9-10(11(8)13(2,3)4)12(14-5)16-15-9;1-8-5-6-9-11(10(7-14)16-15-9)12(8)13(2,3)4;1-8-6-7-10-11(9(2)14-15-10)12(8)13(3,4)5;1-7-5-6-8-9(11(13)15-14-8)10(7)12(2,3)4;2*1-6-5-7(13)10-8(11(14)16-15-10)9(6)12(2,3)4;2*1-7-5-6-8-9(11(13)15-14-8)10(7)12(2,3)4;1-7-5-6-8-9(10(7)12(2,3)4)11(14-13-8)15(16)17;1-7-5-6-8-9(11(13)15-14-8)10(7)12(2,3)4;1-7-5-6-8-9(11(15)14-13-8)10(7)12(2,3)4;1-8-5-6-10-9(7-13-14-10)11(8)12(2,3)4;1-11(2,3)10-7-6-13-14-9(7)5-4-8(10)12;1-11(2,3)10-8-6-4-5-7-9(8)12-13-10/h5,8,10H,6-7H2,1-4H3,(H,16,17);5-10H,1-4H3;4-9,15H,1-3H3;5-6H,1-4H3,(H2,14,17)(H,15,16);6-7H,1-5H3,(H2,14,15,16);5-6H,1-4H3,(H,15,16);6-7H,1-5H3,(H,14,15);5-6H,1-4H3,(H,14,15);5H,1-4H3,(H,15,16);5H,1-4H3,(H3,14,15,16);2*5-6H,1-4H3,(H,14,15);5-6H,1-4H3,(H,13,14);5-6H,1-4H3,(H3,13,14,15);5-6H,1-4H3,(H2,13,14,15);5-7H,1-4H3,(H,13,14);4-6H,1-3H3,(H,13,14);4-7H,1-3H3,(H,12,13).
What are the key properties of 4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol?
4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol has a molecular weight of 3907.86 g/mol, XLogP of 59.10, 5 rotatable bonds, 22 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-5-chloro-1H-indazole;4-tert-butyl-3-chloro-5-methyl-2H-indazole;4-tert-butyl-3-cyclopropyl-5-methyl-2H-indazole;4-tert-butyl-3,7-difluoro-5-methyl-2H-indazole;4-tert-butyl-N,5-dimethyl-1H-indazol-3-amine;4-tert-butyl-3,5-dimethyl-2H-indazole;4-tert-butyl-7-fluoro-5-methyl-1H-indazol-3-amine;4-tert-butyl-3-fluoro-5-methyl-2H-indazole;3-tert-butyl-2H-indazole;4-tert-butyl-3-iodo-5-methyl-2H-indazole;1-tert-butyl-3-methoxynaphthalene;4-tert-butyl-5-methyl-1,2-dihydroindazol-3-one;4-tert-butyl-5-methyl-1H-indazol-3-amine;4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-methyl-1H-indazole-3-carbonitrile;4-tert-butyl-5-methyl-1H-indazole-3-carboxamide;4-tert-butyl-5-methyl-3-nitro-2H-indazole;4-tert-butylnaphthalen-2-ol is sourced from PubChem (CID 167689654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).