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

C72H62Cl6FN13O10S4 — CID 158707778

IUPAC6-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
SMILESCOc1cc(S(C)(=O)=O)ccc1-c1cc(Cl)cc2[nH]ncc12.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1Cl.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1F.Cc1cc(S(C)(=O)=O)ccc1-c1cc(Cl)cc2[nH]ncc12.O=C1NCC2(CCN(c3cc(Cl)cc4[nH]ncc34)CC2)N1
InChIInChI=1S/C15H13ClN2O3S.C15H13ClN2O2S.C14H10Cl2N2O2S.C14H10ClFN2O2S.C14H16ClN5O/c1-21-15-7-10(22(2,19)20)3-4-11(15)12-5-9(16)6-14-13(12)8-17-18-14;1-9-5-11(21(2,19)20)3-4-12(9)13-6-10(16)7-15-14(13)8-17-18-15;2*1-21(19,20)14-3-2-8(4-12(14)16)10-5-9(15)6-13-11(10)7-17-18-13;15-9-5-11-10(7-17-19-11)12(6-9)20-3-1-14(2-4-20)8-16-13(21)18-14/h3-8H,1-2H3,(H,17,18);3-8H,1-2H3,(H,17,18);2*2-7H,1H3,(H,17,18);5-7H,1-4,8H2,(H,17,19)(H2,16,18,21)
InChIKeyIIIIPERYTKDUMY-UHFFFAOYSA-N
MW1629.35 g/mol
LogP16.12
Rot. Bonds10

About 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

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 (PubChem CID 158707778) has the molecular formula C72H62Cl6FN13O10S4 and a molecular weight of 1629.35 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name6-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
PubChem CID158707778
Molecular FormulaC72H62Cl6FN13O10S4
Molecular Weight1629.35 g/mol
Exact Mass1625.17
IUPAC Name6-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
SMILESCOc1cc(S(C)(=O)=O)ccc1-c1cc(Cl)cc2[nH]ncc12.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1Cl.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1F.Cc1cc(S(C)(=O)=O)ccc1-c1cc(Cl)cc2[nH]ncc12.O=C1NCC2(CCN(c3cc(Cl)cc4[nH]ncc34)CC2)N1
InChIInChI=1S/C15H13ClN2O3S.C15H13ClN2O2S.C14H10Cl2N2O2S.C14H10ClFN2O2S.C14H16ClN5O/c1-21-15-7-10(22(2,19)20)3-4-11(15)12-5-9(16)6-14-13(12)8-17-18-14;1-9-5-11(21(2,19)20)3-4-12(9)13-6-10(16)7-15-14(13)8-17-18-15;2*1-21(19,20)14-3-2-8(4-12(14)16)10-5-9(15)6-13-11(10)7-17-18-13;15-9-5-11-10(7-17-19-11)12(6-9)20-3-1-14(2-4-20)8-16-13(21)18-14/h3-8H,1-2H3,(H,17,18);3-8H,1-2H3,(H,17,18);2*2-7H,1H3,(H,17,18);5-7H,1-4,8H2,(H,17,19)(H2,16,18,21)
InChIKeyIIIIPERYTKDUMY-UHFFFAOYSA-N
XLogP16.12
TPSA333.56 Ų
H-Bond Donors7
H-Bond Acceptors16
Rotatable Bonds10
Heavy Atoms106
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001629.35
LogP ≤ 516.12
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1016

Analyze 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 with MolForge

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Related Compounds

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
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-(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-(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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is COc1cc(S(C)(=O)=O)ccc1-c1cc(Cl)cc2[nH]ncc12.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1Cl.CS(=O)(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1F.Cc1cc(S(C)(=O)=O)ccc1-c1cc(Cl)cc2[nH]ncc12.O=C1NCC2(CCN(c3cc(Cl)cc4[nH]ncc34)CC2)N1.
What is the InChIKey of 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?
The InChIKey is IIIIPERYTKDUMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O3S.C15H13ClN2O2S.C14H10Cl2N2O2S.C14H10ClFN2O2S.C14H16ClN5O/c1-21-15-7-10(22(2,19)20)3-4-11(15)12-5-9(16)6-14-13(12)8-17-18-14;1-9-5-11(21(2,19)20)3-4-12(9)13-6-10(16)7-15-14(13)8-17-18-15;2*1-21(19,20)14-3-2-8(4-12(14)16)10-5-9(15)6-13-11(10)7-17-18-13;15-9-5-11-10(7-17-19-11)12(6-9)20-3-1-14(2-4-20)8-16-13(21)18-14/h3-8H,1-2H3,(H,17,18);3-8H,1-2H3,(H,17,18);2*2-7H,1H3,(H,17,18);5-7H,1-4,8H2,(H,17,19)(H2,16,18,21).
What are the key properties of 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?
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 has a molecular weight of 1629.35 g/mol, XLogP of 16.12, 10 rotatable bonds, 7 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 158707778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).