6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole

C63H61Cl5FN13O7S2 — CID 158362002

IUPAC6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole
SMILESCC(C)COc1cccc2[nH]ncc12.CCNC(=O)c1cc(Cl)cc2[nH]ncc12.CN(C)C(=O)C1CCN(c2cc(Cl)cc3[nH]ncc23)C1.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1Cl.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1F
InChIInChI=1S/C14H10Cl2N2O2S.C14H10ClFN2O2S.C14H17ClN4O.C11H14N2O.C10H10ClN3O/c2*1-21(19,20)14-3-2-8(4-12(14)16)10-5-9(15)6-13-11(10)7-17-18-13;1-18(2)14(20)9-3-4-19(8-9)13-6-10(15)5-12-11(13)7-16-17-12;1-8(2)7-14-11-5-3-4-10-9(11)6-12-13-10;1-2-12-10(15)7-3-6(11)4-9-8(7)5-13-14-9/h2*2-7H,1H3,(H,17,18);5-7,9H,3-4,8H2,1-2H3,(H,16,17);3-6,8H,7H2,1-2H3,(H,12,13);3-5H,2H2,1H3,(H,12,15)(H,13,14)
InChIKeyGTOWTYXVBAPJHJ-UHFFFAOYSA-N
MW1372.66 g/mol
LogP14.06
Rot. Bonds11

About 6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole

6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole (PubChem CID 158362002) has the molecular formula C63H61Cl5FN13O7S2 and a molecular weight of 1372.66 g/mol. Its IUPAC name is 6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole.

Molecular Properties

Compound Name6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole
PubChem CID158362002
Molecular FormulaC63H61Cl5FN13O7S2
Molecular Weight1372.66 g/mol
Exact Mass1369.27
IUPAC Name6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole
SMILESCC(C)COc1cccc2[nH]ncc12.CCNC(=O)c1cc(Cl)cc2[nH]ncc12.CN(C)C(=O)C1CCN(c2cc(Cl)cc3[nH]ncc23)C1.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1Cl.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1F
InChIInChI=1S/C14H10Cl2N2O2S.C14H10ClFN2O2S.C14H17ClN4O.C11H14N2O.C10H10ClN3O/c2*1-21(19,20)14-3-2-8(4-12(14)16)10-5-9(15)6-13-11(10)7-17-18-13;1-18(2)14(20)9-3-4-19(8-9)13-6-10(15)5-12-11(13)7-16-17-12;1-8(2)7-14-11-5-3-4-10-9(11)6-12-13-10;1-2-12-10(15)7-3-6(11)4-9-8(7)5-13-14-9/h2*2-7H,1H3,(H,17,18);5-7,9H,3-4,8H2,1-2H3,(H,16,17);3-6,8H,7H2,1-2H3,(H,12,13);3-5H,2H2,1H3,(H,12,15)(H,13,14)
InChIKeyGTOWTYXVBAPJHJ-UHFFFAOYSA-N
XLogP14.06
TPSA273.56 Ų
H-Bond Donors6
H-Bond Acceptors13
Rotatable Bonds11
Heavy Atoms91
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001372.66
LogP ≤ 514.06
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1013

Analyze 6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole with MolForge

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Related Compounds

5-(6-chloro-1H-indazol-4-yl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine;1-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrrolidin-2-one;1'-(6-chloro-1H-indazol-4-yl)spiro[1H-indole-3,4'-piperidine]-2-one;6-chloro-4-(4-methylsulfonylphenoxy)-1H-indazole;4-(3,3-dimethyl-4-methylsulfonylpiperazin-1-yl)-6-(trifluoromethyl)-1H-indazole
CID 159449438
1-(6-chloro-1H-indazol-4-yl)cyclohexan-1-ol;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzenesulfonamide;1-(6-chloro-1H-indazol-4-yl)-3-methylbutan-1-ol;N-[[4-(6-chloro-1H-indazol-4-yl)phenyl]methyl]acetamide;(6-chloro-1H-indazol-4-yl)-piperidin-1-ylmethanone;1-[4-[6-(trifluoromethoxy)-1H-indazol-4-yl]piperidin-1-yl]ethanone
CID 161827664
6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole
CID 158635777
6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one;6-chloro-4-(2-methoxy-4-methylsulfonylphenyl)-1H-indazole;6-chloro-4-(2-methyl-4-methylsulfonylphenyl)-1H-indazole
CID 158707778
3-(1-acetylpiperidin-4-yl)-1-(6-chloro-1H-indazol-4-yl)propan-1-one;1-(6-chloro-1H-indazol-4-yl)-2-cyclohexylethanol;(6-chloro-1H-indazol-4-yl)-cyclohexylmethanol;N-[[4-(6-chloro-1H-indazol-4-yl)phenyl]methyl]methanesulfonamide;6-chloro-4-(3-methoxy-4-methylsulfonylphenyl)-1H-indazole
CID 158818557
4-(6-chloro-1H-indazol-4-yl)benzenesulfonamide;4-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]butan-2-one;8-(6-chloro-1H-indazol-4-yl)-1,3,8-triazaspiro[4.5]decan-2-one;6-chloro-4-(2-methoxy-4-methylsulfonylphenyl)-1H-indazole;6-chloro-4-(2-methyl-4-methylsulfonylphenyl)-1H-indazole
CID 160129515
6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole
CID 161247156
3-(1-acetylpiperidin-4-yl)-1-(6-chloro-1H-indazol-4-yl)propan-1-one;6-chloro-4-(2-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N-methylpyrrolidine-3-carboxamide;(6-chloro-1H-indazol-4-yl)-(oxan-4-yl)methanol;6-chloro-4-(3-methoxy-4-methylsulfonylphenyl)-1H-indazole
CID 161388466
6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;6-chloro-4-(2-methoxy-4-methylsulfonylphenyl)-1H-indazole;4-(2-methylpropoxy)-1H-indazole
CID 161397232
6-chloro-4-(2-fluoro-4-methylsulfonylphenyl)-1H-indazole;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzenesulfonamide;1-(6-chloro-1H-indazol-4-yl)-N-methylpyrrolidine-3-carboxamide;(6-chloro-1H-indazol-4-yl)-(oxan-4-yl)methanol;6-chloro-4-(3-methoxy-4-methylsulfonylphenyl)-1H-indazole
CID 161434439

Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole?
The IUPAC name of 6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole (CID 158362002) is 6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole.
What is the SMILES notation for 6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole?
The canonical SMILES for 6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole is CC(C)COc1cccc2[nH]ncc12.CCNC(=O)c1cc(Cl)cc2[nH]ncc12.CN(C)C(=O)C1CCN(c2cc(Cl)cc3[nH]ncc23)C1.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1Cl.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1F.
What is the InChIKey of 6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole?
The InChIKey is GTOWTYXVBAPJHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2N2O2S.C14H10ClFN2O2S.C14H17ClN4O.C11H14N2O.C10H10ClN3O/c2*1-21(19,20)14-3-2-8(4-12(14)16)10-5-9(15)6-13-11(10)7-17-18-13;1-18(2)14(20)9-3-4-19(8-9)13-6-10(15)5-12-11(13)7-16-17-12;1-8(2)7-14-11-5-3-4-10-9(11)6-12-13-10;1-2-12-10(15)7-3-6(11)4-9-8(7)5-13-14-9/h2*2-7H,1H3,(H,17,18);5-7,9H,3-4,8H2,1-2H3,(H,16,17);3-6,8H,7H2,1-2H3,(H,12,13);3-5H,2H2,1H3,(H,12,15)(H,13,14).
What are the key properties of 6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole?
6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole has a molecular weight of 1372.66 g/mol, XLogP of 14.06, 11 rotatable bonds, 6 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-(3-chloro-4-methylsulfonylphenyl)-1H-indazole;6-chloro-N-ethyl-1H-indazole-4-carboxamide;6-chloro-4-(3-fluoro-4-methylsulfonylphenyl)-1H-indazole;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;4-(2-methylpropoxy)-1H-indazole is sourced from PubChem (CID 158362002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).