bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene

C139H141Cl6N13O8S6 — CID 159451195

About bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene

bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene (PubChem CID 159451195) has the molecular formula C139H141Cl6N13O8S6 and a molecular weight of 2526.86 g/mol. Its IUPAC name is bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene.

Molecular Properties

• Compound Name: bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene
• PubChem CID: 159451195
• Molecular Formula: C139H141Cl6N13O8S6
• Molecular Weight: 2526.86 g/mol
• Exact Mass: 2521.75
• IUPAC Name: bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene
• SMILES: C.COC1=NC2SC(C)=CC2C=C1.COc1ccc(C)s1.COc1ccc2[nH]c(C)cc2c1.COc1ccc2cc(C)ccc2c1.COc1ccc2cc(C)sc2c1.COc1ccc2sc(C)cc2c1.COc1ccc2sc(C)cc2n1.COc1cnc2cc(C)sc2c1.Cc1cc2[nH]cc(Cl)c2cn1.Cc1cc2cc(Cl)ccc2[nH]1.Cc1cc2cc(Cl)cnc2[nH]1.Cc1ccc2c(C)c[nH]c2c1.Cc1ccc2c(Cl)c[nH]c2c1.Cc1ccc2c(Cl)c[nH]c2c1.Cc1cnc2cc(Cl)ccc2c1
• InChI: InChI=1S/C12H12O.C10H8ClN.C10H11NO.C10H11N.2C10H10OS.3C9H8ClN.2C9H9NOS.C9H11NOS.2C8H7ClN2.C6H8OS.CH4/c1-9-3-4-11-8-12(13-2)6-5-10(11)7-9;1-7-4-8-2-3-9(11)5-10(8)12-6-7;1-7-5-8-6-9(12-2)3-4-10(8)11-7;1-7-3-4-9-8(2)6-11-10(9)5-7;1-7-5-8-6-9(11-2)3-4-10(8)12-7;1-7-5-8-3-4-9(11-2)6-10(8)12-7;1-6-4-7-5-8(10)2-3-9(7)11-6;2*1-6-2-3-7-8(10)5-11-9(7)4-6;1-6-3-8-9(12-6)4-7(11-2)5-10-8;1-6-5-7-8(12-6)3-4-9(10-7)11-2;1-6-5-7-3-4-8(11-2)10-9(7)12-6;1-5-2-8-6(3-10-5)7(9)4-11-8;1-5-2-6-3-7(9)4-10-8(6)11-5;1-5-3-4-6(7-2)8-5;/h3-8H,1-2H3;2-6H,1H3;3-6,11H,1-2H3;3-6,11H,1-2H3;2*3-6H,1-2H3;3*2-5,11H,1H3;2*3-5H,1-2H3;3-5,7,9H,1-2H3;2-4,11H,1H3;2-4H,1H3,(H,10,11);3-4H,1-2H3;1H4
• InChIKey: LTJZVQIXVNXUFY-UHFFFAOYSA-N
• XLogP: 42.62
• TPSA: 261.18 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 20
• Rotatable Bonds: 7
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2526.86
LogP ≤ 5	42.62
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene?

The IUPAC name of bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene (CID 159451195) is bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene.

What is the SMILES notation for bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene?

The canonical SMILES for bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene is C.COC1=NC2SC(C)=CC2C=C1.COc1ccc(C)s1.COc1ccc2[nH]c(C)cc2c1.COc1ccc2cc(C)ccc2c1.COc1ccc2cc(C)sc2c1.COc1ccc2sc(C)cc2c1.COc1ccc2sc(C)cc2n1.COc1cnc2cc(C)sc2c1.Cc1cc2[nH]cc(Cl)c2cn1.Cc1cc2cc(Cl)ccc2[nH]1.Cc1cc2cc(Cl)cnc2[nH]1.Cc1ccc2c(C)c[nH]c2c1.Cc1ccc2c(Cl)c[nH]c2c1.Cc1ccc2c(Cl)c[nH]c2c1.Cc1cnc2cc(Cl)ccc2c1.

What is the InChIKey of bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene?

The InChIKey is LTJZVQIXVNXUFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O.C10H8ClN.C10H11NO.C10H11N.2C10H10OS.3C9H8ClN.2C9H9NOS.C9H11NOS.2C8H7ClN2.C6H8OS.CH4/c1-9-3-4-11-8-12(13-2)6-5-10(11)7-9;1-7-4-8-2-3-9(11)5-10(8)12-6-7;1-7-5-8-6-9(12-2)3-4-10(8)11-7;1-7-3-4-9-8(2)6-11-10(9)5-7;1-7-5-8-6-9(11-2)3-4-10(8)12-7;1-7-5-8-3-4-9(11-2)6-10(8)12-7;1-6-4-7-5-8(10)2-3-9(7)11-6;2*1-6-2-3-7-8(10)5-11-9(7)4-6;1-6-3-8-9(12-6)4-7(11-2)5-10-8;1-6-5-7-8(12-6)3-4-9(10-7)11-2;1-6-5-7-3-4-8(11-2)10-9(7)12-6;1-5-2-8-6(3-10-5)7(9)4-11-8;1-5-2-6-3-7(9)4-10-8(6)11-5;1-5-3-4-6(7-2)8-5;/h3-8H,1-2H3;2-6H,1H3;3-6,11H,1-2H3;3-6,11H,1-2H3;2*3-6H,1-2H3;3*2-5,11H,1H3;2*3-5H,1-2H3;3-5,7,9H,1-2H3;2-4,11H,1H3;2-4H,1H3,(H,10,11);3-4H,1-2H3;1H4.

What are the key properties of bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene?

bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene has a molecular weight of 2526.86 g/mol, XLogP of 42.62, 7 rotatable bonds, 7 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for bis(3-chloro-6-methyl-1H-indole);5-chloro-2-methyl-1H-indole;5-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine;3-chloro-6-methyl-1H-pyrrolo[3,2-c]pyridine;7-chloro-3-methylquinoline;3,6-dimethyl-1H-indole;methane;6-methoxy-2-methyl-3a,7a-dihydrothieno[2,3-b]pyridine;5-methoxy-2-methyl-1-benzothiophene;6-methoxy-2-methyl-1-benzothiophene;5-methoxy-2-methyl-1H-indole;2-methoxy-6-methylnaphthalene;5-methoxy-2-methylthieno[3,2-b]pyridine;6-methoxy-2-methylthieno[3,2-b]pyridine;2-methoxy-5-methylthiophene is sourced from PubChem (CID 159451195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).