6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine

C107H64Cl10F3N19S — CID 158479609

IUPAC6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESClc1ccc(Cl)c(-c2ncccc2-c2ccc3nc[nH]c3c2)c1.Clc1ccc(Cl)c(-c2ncccc2-c2ccc3nccn3c2)c1.Clc1ccc(Cl)c(-c2ncccc2-c2ccc3ncsc3c2)c1.Clc1ccc(Cl)c(-c2ncccc2-c2ccn3ncnc3c2)c1.Cn1cnc2ccc(-c3cccnc3-c3cc(Cl)ccc3Cl)cc21.Fc1cc(F)c(-c2ncccc2-c2ccn3ncnc3c2)cc1F
InChIInChI=1S/C19H13Cl2N3.2C18H11Cl2N3.C18H10Cl2N2S.C17H10Cl2N4.C17H9F3N4/c1-24-11-23-17-7-4-12(9-18(17)24)14-3-2-8-22-19(14)15-10-13(20)5-6-16(15)21;19-12-4-5-15(20)14(9-12)18-13(2-1-7-21-18)11-3-6-16-17(8-11)23-10-22-16;19-13-4-5-16(20)15(10-13)18-14(2-1-7-22-18)12-3-6-17-21-8-9-23(17)11-12;19-12-4-5-15(20)14(9-12)18-13(2-1-7-21-18)11-3-6-16-17(8-11)23-10-22-16;18-12-3-4-15(19)14(9-12)17-13(2-1-6-20-17)11-5-7-23-16(8-11)21-10-22-23;18-13-8-15(20)14(19)7-12(13)17-11(2-1-4-21-17)10-3-5-24-16(6-10)22-9-23-24/h2-11H,1H3;1-10H,(H,22,23);1-11H;2*1-10H;1-9H
InChIKeyHHJAPERJQZUXPD-UHFFFAOYSA-N
MW2059.41 g/mol
LogP31.55
Rot. Bonds12

About 6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine

6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 158479609) has the molecular formula C107H64Cl10F3N19S and a molecular weight of 2059.41 g/mol. Its IUPAC name is 6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID158479609
Molecular FormulaC107H64Cl10F3N19S
Molecular Weight2059.41 g/mol
Exact Mass2053.22
IUPAC Name6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESClc1ccc(Cl)c(-c2ncccc2-c2ccc3nc[nH]c3c2)c1.Clc1ccc(Cl)c(-c2ncccc2-c2ccc3nccn3c2)c1.Clc1ccc(Cl)c(-c2ncccc2-c2ccc3ncsc3c2)c1.Clc1ccc(Cl)c(-c2ncccc2-c2ccn3ncnc3c2)c1.Cn1cnc2ccc(-c3cccnc3-c3cc(Cl)ccc3Cl)cc21.Fc1cc(F)c(-c2ncccc2-c2ccn3ncnc3c2)cc1F
InChIInChI=1S/C19H13Cl2N3.2C18H11Cl2N3.C18H10Cl2N2S.C17H10Cl2N4.C17H9F3N4/c1-24-11-23-17-7-4-12(9-18(17)24)14-3-2-8-22-19(14)15-10-13(20)5-6-16(15)21;19-12-4-5-15(20)14(9-12)18-13(2-1-7-21-18)11-3-6-16-17(8-11)23-10-22-16;19-13-4-5-16(20)15(10-13)18-14(2-1-7-22-18)12-3-6-17-21-8-9-23(17)11-12;19-12-4-5-15(20)14(9-12)18-13(2-1-7-21-18)11-3-6-16-17(8-11)23-10-22-16;18-12-3-4-15(19)14(9-12)17-13(2-1-6-20-17)11-5-7-23-16(8-11)21-10-22-23;18-13-8-15(20)14(19)7-12(13)17-11(2-1-4-21-17)10-3-5-24-16(6-10)22-9-23-24/h2-11H,1H3;1-10H,(H,22,23);1-11H;2*1-10H;1-9H
InChIKeyHHJAPERJQZUXPD-UHFFFAOYSA-N
XLogP31.55
TPSA214.41 Ų
H-Bond Donors1
H-Bond Acceptors19
Rotatable Bonds12
Heavy Atoms140
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002059.41
LogP ≤ 531.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze 6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine (CID 158479609) is 6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine is Clc1ccc(Cl)c(-c2ncccc2-c2ccc3nc[nH]c3c2)c1.Clc1ccc(Cl)c(-c2ncccc2-c2ccc3nccn3c2)c1.Clc1ccc(Cl)c(-c2ncccc2-c2ccc3ncsc3c2)c1.Clc1ccc(Cl)c(-c2ncccc2-c2ccn3ncnc3c2)c1.Cn1cnc2ccc(-c3cccnc3-c3cc(Cl)ccc3Cl)cc21.Fc1cc(F)c(-c2ncccc2-c2ccn3ncnc3c2)cc1F.
What is the InChIKey of 6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is HHJAPERJQZUXPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13Cl2N3.2C18H11Cl2N3.C18H10Cl2N2S.C17H10Cl2N4.C17H9F3N4/c1-24-11-23-17-7-4-12(9-18(17)24)14-3-2-8-22-19(14)15-10-13(20)5-6-16(15)21;19-12-4-5-15(20)14(9-12)18-13(2-1-7-21-18)11-3-6-16-17(8-11)23-10-22-16;19-13-4-5-16(20)15(10-13)18-14(2-1-7-22-18)12-3-6-17-21-8-9-23(17)11-12;19-12-4-5-15(20)14(9-12)18-13(2-1-7-21-18)11-3-6-16-17(8-11)23-10-22-16;18-12-3-4-15(19)14(9-12)17-13(2-1-6-20-17)11-5-7-23-16(8-11)21-10-22-23;18-13-8-15(20)14(19)7-12(13)17-11(2-1-4-21-17)10-3-5-24-16(6-10)22-9-23-24/h2-11H,1H3;1-10H,(H,22,23);1-11H;2*1-10H;1-9H.
What are the key properties of 6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine?
6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 2059.41 g/mol, XLogP of 31.55, 12 rotatable bonds, 1 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1H-benzimidazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1,3-benzothiazole;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(2,5-dichlorophenyl)-3-pyridinyl]-1-methylbenzimidazole;7-[2-(2,5-dichlorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 158479609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).