2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine

C71H52ClF21N20O8S4 — CID 159441174

About 2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine

2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine (PubChem CID 159441174) has the molecular formula C71H52ClF21N20O8S4 and a molecular weight of 1876.01 g/mol. Its IUPAC name is 2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine.

Molecular Properties

• Compound Name: 2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine
• PubChem CID: 159441174
• Molecular Formula: C71H52ClF21N20O8S4
• Molecular Weight: 1876.01 g/mol
• Exact Mass: 1874.25
• IUPAC Name: 2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine
• SMILES: CCS(=O)(=O)c1c2c(Cl)cccc2nn1-c1nc2cc(C(F)(F)F)cnc2n1C.CCS(=O)(=O)c1c2ccc(C(F)(F)F)cc2nn1-c1nc2cc(C(F)(F)F)ncc2n1C.CCS(=O)(=O)c1nn(-c2nc3cc(C(F)(F)F)cnc3n2C)c2cc(C(F)(F)F)ccc12.CCS(=O)(=O)c1nn(-c2nc3cc(C(F)(F)F)cnc3n2C)c2ccc(C(F)(F)F)cc12
• InChI: InChI=1S/3C18H13F6N5O2S.C17H13ClF3N5O2S/c1-3-32(30,31)15-11-5-4-9(17(19,20)21)7-13(11)29(27-15)16-26-12-6-10(18(22,23)24)8-25-14(12)28(16)2;1-3-32(30,31)15-11-6-9(17(19,20)21)4-5-13(11)29(27-15)16-26-12-7-10(18(22,23)24)8-25-14(12)28(16)2;1-3-32(30,31)15-10-5-4-9(17(19,20)21)6-11(10)27-29(15)16-26-12-7-14(18(22,23)24)25-8-13(12)28(16)2;1-3-29(27,28)15-13-10(18)5-4-6-11(13)24-26(15)16-23-12-7-9(17(19,20)21)8-22-14(12)25(16)2/h3*4-8H,3H2,1-2H3;4-8H,3H2,1-2H3
• InChIKey: LSERWQIMFHMASW-UHFFFAOYSA-N
• XLogP: 16.19
• TPSA: 330.68 Ų
• H-Bond Acceptors: 28
• Rotatable Bonds: 12
• Heavy Atoms: 125
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1876.01
LogP ≤ 5	16.19
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	28

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine?

The IUPAC name of 2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine (CID 159441174) is 2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine.

What is the SMILES notation for 2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine?

The canonical SMILES for 2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine is CCS(=O)(=O)c1c2c(Cl)cccc2nn1-c1nc2cc(C(F)(F)F)cnc2n1C.CCS(=O)(=O)c1c2ccc(C(F)(F)F)cc2nn1-c1nc2cc(C(F)(F)F)ncc2n1C.CCS(=O)(=O)c1nn(-c2nc3cc(C(F)(F)F)cnc3n2C)c2cc(C(F)(F)F)ccc12.CCS(=O)(=O)c1nn(-c2nc3cc(C(F)(F)F)cnc3n2C)c2ccc(C(F)(F)F)cc12.

What is the InChIKey of 2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine?

The InChIKey is LSERWQIMFHMASW-UHFFFAOYSA-N. The full InChI is InChI=1S/3C18H13F6N5O2S.C17H13ClF3N5O2S/c1-3-32(30,31)15-11-5-4-9(17(19,20)21)7-13(11)29(27-15)16-26-12-6-10(18(22,23)24)8-25-14(12)28(16)2;1-3-32(30,31)15-11-6-9(17(19,20)21)4-5-13(11)29(27-15)16-26-12-7-10(18(22,23)24)8-25-14(12)28(16)2;1-3-32(30,31)15-10-5-4-9(17(19,20)21)6-11(10)27-29(15)16-26-12-7-14(18(22,23)24)25-8-13(12)28(16)2;1-3-29(27,28)15-13-10(18)5-4-6-11(13)24-26(15)16-23-12-7-9(17(19,20)21)8-22-14(12)25(16)2/h3*4-8H,3H2,1-2H3;4-8H,3H2,1-2H3.

What are the key properties of 2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine?

2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine has a molecular weight of 1876.01 g/mol, XLogP of 16.19, 12 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-chloro-3-ethylsulfonylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-5-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-1-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-[3-ethylsulfonyl-6-(trifluoromethyl)indazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine is sourced from PubChem (CID 159441174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).