2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine

C92H91ClF15N25O6S5 — CID 158043160

About 2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine

2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine (PubChem CID 158043160) has the molecular formula C92H91ClF15N25O6S5 and a molecular weight of 2123.67 g/mol. Its IUPAC name is 2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine.

Molecular Properties

• Compound Name: 2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine
• PubChem CID: 158043160
• Molecular Formula: C92H91ClF15N25O6S5
• Molecular Weight: 2123.67 g/mol
• Exact Mass: 2121.56
• IUPAC Name: 2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine
• SMILES: CCS(=O)(=O)c1c2c(nn1-c1nc3cc(C(C)(F)F)cnc3n1C)CCCC2.CCS(=O)(=O)c1c2c(nn1-c1nc3cc(C(F)(F)F)cnc3n1C)CC(C)(C)CC2.CCS(=O)(=O)c1c2cccc(C(C)(F)F)c2nn1-c1nc2cc(C(F)(F)F)cnc2n1C.CCSc1c2cc(C)ccc2nn1-c1nc2cc(C(F)(F)F)cnc2n1C.CCSc1c2ccc(Cl)cc2nn1-c1nc2cc(C(C)(F)F)cnc2n1C
• InChI: InChI=1S/C19H16F5N5O2S.C19H22F3N5O2S.C18H16ClF2N5S.C18H16F3N5S.C18H21F2N5O2S/c1-4-32(30,31)16-11-6-5-7-12(18(2,20)21)14(11)27-29(16)17-26-13-8-10(19(22,23)24)9-25-15(13)28(17)3;1-5-30(28,29)16-12-6-7-18(2,3)9-14(12)25-27(16)17-24-13-8-11(19(20,21)22)10-23-15(13)26(17)4;1-4-27-16-12-6-5-11(19)8-13(12)24-26(16)17-23-14-7-10(18(2,20)21)9-22-15(14)25(17)3;1-4-27-16-12-7-10(2)5-6-13(12)24-26(16)17-23-14-8-11(18(19,20)21)9-22-15(14)25(17)3;1-4-28(26,27)16-12-7-5-6-8-13(12)23-25(16)17-22-14-9-11(18(2,19)20)10-21-15(14)24(17)3/h5-9H,4H2,1-3H3;8,10H,5-7,9H2,1-4H3;2*5-9H,4H2,1-3H3;9-10H,4-8H2,1-3H3
• InChIKey: FIPFEQXZWBYLSO-UHFFFAOYSA-N
• XLogP: 20.58
• TPSA: 345.07 Ų
• H-Bond Acceptors: 33
• Rotatable Bonds: 18
• Heavy Atoms: 144
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2123.67
LogP ≤ 5	20.58
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	33

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine?

The IUPAC name of 2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine (CID 158043160) is 2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine.

What is the SMILES notation for 2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine?

The canonical SMILES for 2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine is CCS(=O)(=O)c1c2c(nn1-c1nc3cc(C(C)(F)F)cnc3n1C)CCCC2.CCS(=O)(=O)c1c2c(nn1-c1nc3cc(C(F)(F)F)cnc3n1C)CC(C)(C)CC2.CCS(=O)(=O)c1c2cccc(C(C)(F)F)c2nn1-c1nc2cc(C(F)(F)F)cnc2n1C.CCSc1c2cc(C)ccc2nn1-c1nc2cc(C(F)(F)F)cnc2n1C.CCSc1c2ccc(Cl)cc2nn1-c1nc2cc(C(C)(F)F)cnc2n1C.

What is the InChIKey of 2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine?

The InChIKey is FIPFEQXZWBYLSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F5N5O2S.C19H22F3N5O2S.C18H16ClF2N5S.C18H16F3N5S.C18H21F2N5O2S/c1-4-32(30,31)16-11-6-5-7-12(18(2,20)21)14(11)27-29(16)17-26-13-8-10(19(22,23)24)9-25-15(13)28(17)3;1-5-30(28,29)16-12-6-7-18(2,3)9-14(12)25-27(16)17-24-13-8-11(19(20,21)22)10-23-15(13)26(17)4;1-4-27-16-12-6-5-11(19)8-13(12)24-26(16)17-23-14-7-10(18(2,20)21)9-22-15(14)25(17)3;1-4-27-16-12-7-10(2)5-6-13(12)24-26(16)17-23-14-8-11(18(19,20)21)9-22-15(14)25(17)3;1-4-28(26,27)16-12-7-5-6-8-13(12)23-25(16)17-22-14-9-11(18(2,19)20)10-21-15(14)24(17)3/h5-9H,4H2,1-3H3;8,10H,5-7,9H2,1-4H3;2*5-9H,4H2,1-3H3;9-10H,4-8H2,1-3H3.

What are the key properties of 2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine?

2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine has a molecular weight of 2123.67 g/mol, XLogP of 20.58, 18 rotatable bonds, 0 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(6-chloro-3-ethylsulfanylindazol-2-yl)-6-(1,1-difluoroethyl)-3-methylimidazo[4,5-b]pyridine;2-[7-(1,1-difluoroethyl)-3-ethylsulfonylindazol-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;6-(1,1-difluoroethyl)-2-(3-ethylsulfonyl-4,5,6,7-tetrahydroindazol-2-yl)-3-methylimidazo[4,5-b]pyridine;2-(3-ethylsulfanyl-5-methylindazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine;2-(3-ethylsulfonyl-6,6-dimethyl-5,7-dihydro-4H-indazol-2-yl)-3-methyl-6-(trifluoromethyl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 158043160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).