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

C69H65Cl5FN13O10S3 — CID 161434439

IUPAC6-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
SMILESCNC(=O)C1CCN(c2cc(Cl)cc3[nH]ncc23)C1.CNS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.COc1cc(-c2cc(Cl)cc3[nH]ncc23)ccc1S(C)(=O)=O.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)c(F)c1.OC(c1cc(Cl)cc2[nH]ncc12)C1CCOCC1
InChIInChI=1S/C15H13ClN2O3S.C14H10ClFN2O2S.C14H12ClN3O2S.C13H15ClN4O.C13H15ClN2O2/c1-21-14-5-9(3-4-15(14)22(2,19)20)11-6-10(16)7-13-12(11)8-17-18-13;1-21(19,20)9-2-3-10(13(16)6-9)11-4-8(15)5-14-12(11)7-17-18-14;1-16-21(19,20)11-4-2-9(3-5-11)12-6-10(15)7-14-13(12)8-17-18-14;1-15-13(19)8-2-3-18(7-8)12-5-9(14)4-11-10(12)6-16-17-11;14-9-5-10(11-7-15-16-12(11)6-9)13(17)8-1-3-18-4-2-8/h3-8H,1-2H3,(H,17,18);2-7H,1H3,(H,17,18);2-8,16H,1H3,(H,17,18);4-6,8H,2-3,7H2,1H3,(H,15,19)(H,16,17);5-8,13,17H,1-4H2,(H,15,16)
InChIKeyVYLLWUQQEWICET-UHFFFAOYSA-N
MW1528.82 g/mol
LogP13.98
Rot. Bonds12

About 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

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 (PubChem CID 161434439) has the molecular formula C69H65Cl5FN13O10S3 and a molecular weight of 1528.82 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name6-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
PubChem CID161434439
Molecular FormulaC69H65Cl5FN13O10S3
Molecular Weight1528.82 g/mol
Exact Mass1525.26
IUPAC Name6-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
SMILESCNC(=O)C1CCN(c2cc(Cl)cc3[nH]ncc23)C1.CNS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.COc1cc(-c2cc(Cl)cc3[nH]ncc23)ccc1S(C)(=O)=O.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)c(F)c1.OC(c1cc(Cl)cc2[nH]ncc12)C1CCOCC1
InChIInChI=1S/C15H13ClN2O3S.C14H10ClFN2O2S.C14H12ClN3O2S.C13H15ClN4O.C13H15ClN2O2/c1-21-14-5-9(3-4-15(14)22(2,19)20)11-6-10(16)7-13-12(11)8-17-18-13;1-21(19,20)9-2-3-10(13(16)6-9)11-4-8(15)5-14-12(11)7-17-18-14;1-16-21(19,20)11-4-2-9(3-5-11)12-6-10(15)7-14-13(12)8-17-18-14;1-15-13(19)8-2-3-18(7-8)12-5-9(14)4-11-10(12)6-16-17-11;14-9-5-10(11-7-15-16-12(11)6-9)13(17)8-1-3-18-4-2-8/h3-8H,1-2H3,(H,17,18);2-7H,1H3,(H,17,18);2-8,16H,1H3,(H,17,18);4-6,8H,2-3,7H2,1H3,(H,15,19)(H,16,17);5-8,13,17H,1-4H2,(H,15,16)
InChIKeyVYLLWUQQEWICET-UHFFFAOYSA-N
XLogP13.98
TPSA328.88 Ų
H-Bond Donors8
H-Bond Acceptors16
Rotatable Bonds12
Heavy Atoms101
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001528.82
LogP ≤ 513.98
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1016

Analyze 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 with MolForge

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Related Compounds

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-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
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-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
CID 160400854
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;1-(6-chloro-1H-indazol-4-yl)piperidine-4-carboxylic acid
CID 160829451
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

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CNC(=O)C1CCN(c2cc(Cl)cc3[nH]ncc23)C1.CNS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.COc1cc(-c2cc(Cl)cc3[nH]ncc23)ccc1S(C)(=O)=O.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)c(F)c1.OC(c1cc(Cl)cc2[nH]ncc12)C1CCOCC1.
What is the InChIKey of 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?
The InChIKey is VYLLWUQQEWICET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O3S.C14H10ClFN2O2S.C14H12ClN3O2S.C13H15ClN4O.C13H15ClN2O2/c1-21-14-5-9(3-4-15(14)22(2,19)20)11-6-10(16)7-13-12(11)8-17-18-13;1-21(19,20)9-2-3-10(13(16)6-9)11-4-8(15)5-14-12(11)7-17-18-14;1-16-21(19,20)11-4-2-9(3-5-11)12-6-10(15)7-14-13(12)8-17-18-14;1-15-13(19)8-2-3-18(7-8)12-5-9(14)4-11-10(12)6-16-17-11;14-9-5-10(11-7-15-16-12(11)6-9)13(17)8-1-3-18-4-2-8/h3-8H,1-2H3,(H,17,18);2-7H,1H3,(H,17,18);2-8,16H,1H3,(H,17,18);4-6,8H,2-3,7H2,1H3,(H,15,19)(H,16,17);5-8,13,17H,1-4H2,(H,15,16).
What are the key properties of 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?
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 has a molecular weight of 1528.82 g/mol, XLogP of 13.98, 12 rotatable bonds, 8 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 161434439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).