2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine

C127H88F8N44O4 — CID 158764840

IUPAC2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine
SMILESCOc1cc(-n2nnc(-c3ccccn3)n2)ccc1-n1ccc2cccnc21.COc1cc(-n2nnc(-c3ccccn3)n2)ccc1-n1cccn1.COc1ccc(C)cc1-c1cc(F)cc(-n2nnc(-c3ccccn3)n2)c1.FC(F)(F)Oc1cc(-n2nnc(-c3ccccn3)n2)ccc1-c1ccccn1.FC(F)(F)c1cc(-n2nnc(-c3ccccn3)n2)ccc1-c1ccccn1.Fc1cc(-n2nnc(-c3ccccn3)n2)ccc1-c1ccccn1.N#Cc1cc(-n2nnc(-c3ccccn3)n2)ccc1-c1ccccn1
InChIInChI=1S/C20H16FN5O.C20H15N7O.C18H11F3N6O.C18H11F3N6.C18H11N7.C17H11FN6.C16H13N7O/c1-13-6-7-19(27-2)17(9-13)14-10-15(21)12-16(11-14)26-24-20(23-25-26)18-5-3-4-8-22-18;1-28-18-13-15(27-24-19(23-25-27)16-6-2-3-10-21-16)7-8-17(18)26-12-9-14-5-4-11-22-20(14)26;19-18(20,21)28-16-11-12(7-8-13(16)14-5-1-3-9-22-14)27-25-17(24-26-27)15-6-2-4-10-23-15;19-18(20,21)14-11-12(7-8-13(14)15-5-1-3-9-22-15)27-25-17(24-26-27)16-6-2-4-10-23-16;19-12-13-11-14(7-8-15(13)16-5-1-3-9-20-16)25-23-18(22-24-25)17-6-2-4-10-21-17;18-14-11-12(7-8-13(14)15-5-1-3-9-19-15)24-22-17(21-23-24)16-6-2-4-10-20-16;1-24-15-11-12(6-7-14(15)22-10-4-9-18-22)23-20-16(19-21-23)13-5-2-3-8-17-13/h3-12H,1-2H3;2-13H,1H3;1-11H;1-11H;1-11H;1-11H;2-11H,1H3
InChIKeyIPCXNKSZKWCRCV-UHFFFAOYSA-N
MW2446.39 g/mol
LogP21.91
Rot. Bonds25

About 2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine

2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine (PubChem CID 158764840) has the molecular formula C127H88F8N44O4 and a molecular weight of 2446.39 g/mol. Its IUPAC name is 2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine.

Molecular Properties

Compound Name2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine
PubChem CID158764840
Molecular FormulaC127H88F8N44O4
Molecular Weight2446.39 g/mol
Exact Mass2444.79
IUPAC Name2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine
SMILESCOc1cc(-n2nnc(-c3ccccn3)n2)ccc1-n1ccc2cccnc21.COc1cc(-n2nnc(-c3ccccn3)n2)ccc1-n1cccn1.COc1ccc(C)cc1-c1cc(F)cc(-n2nnc(-c3ccccn3)n2)c1.FC(F)(F)Oc1cc(-n2nnc(-c3ccccn3)n2)ccc1-c1ccccn1.FC(F)(F)c1cc(-n2nnc(-c3ccccn3)n2)ccc1-c1ccccn1.Fc1cc(-n2nnc(-c3ccccn3)n2)ccc1-c1ccccn1.N#Cc1cc(-n2nnc(-c3ccccn3)n2)ccc1-c1ccccn1
InChIInChI=1S/C20H16FN5O.C20H15N7O.C18H11F3N6O.C18H11F3N6.C18H11N7.C17H11FN6.C16H13N7O/c1-13-6-7-19(27-2)17(9-13)14-10-15(21)12-16(11-14)26-24-20(23-25-26)18-5-3-4-8-22-18;1-28-18-13-15(27-24-19(23-25-27)16-6-2-3-10-21-16)7-8-17(18)26-12-9-14-5-4-11-22-20(14)26;19-18(20,21)28-16-11-12(7-8-13(16)14-5-1-3-9-22-14)27-25-17(24-26-27)15-6-2-4-10-23-15;19-18(20,21)14-11-12(7-8-13(14)15-5-1-3-9-22-15)27-25-17(24-26-27)16-6-2-4-10-23-16;19-12-13-11-14(7-8-15(13)16-5-1-3-9-20-16)25-23-18(22-24-25)17-6-2-4-10-21-17;18-14-11-12(7-8-13(14)15-5-1-3-9-19-15)24-22-17(21-23-24)16-6-2-4-10-20-16;1-24-15-11-12(6-7-14(15)22-10-4-9-18-22)23-20-16(19-21-23)13-5-2-3-8-17-13/h3-12H,1-2H3;2-13H,1H3;1-11H;1-11H;1-11H;1-11H;2-11H,1H3
InChIKeyIPCXNKSZKWCRCV-UHFFFAOYSA-N
XLogP21.91
TPSA543.34 Ų
H-Bond Donors
H-Bond Acceptors48
Rotatable Bonds25
Heavy Atoms183
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002446.39
LogP ≤ 521.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1048

Analyze 2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine with MolForge

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Related Compounds

1-[8-(4-Fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-1,2-bis[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-2-(5-pyrrolidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)hydrazine
CID 123142615
6-(4-Fluorophenyl)-3-[(6-methoxynaphthalen-1-yl)oxymethyl]-[1,2,4]triazolo[4,3-a]pyridine;4-[[6-(3-fluorophenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methoxy]-7-methoxyquinoline;7-methoxy-4-[[6-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methoxy]quinoline;3-[(6-methoxynaphthalen-1-yl)oxymethyl]-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyridine;7-methoxy-4-[[6-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methoxy]quinoline
CID 157351998
3-(1,1-Difluoroethyl)-6-[2-methoxy-4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[3-methyl-4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[2-methyl-4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;2-[3-(1,1-difluoroethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-5-(trifluoromethyl)benzonitrile;3-(1,1-difluoroethyl)-6-[4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(2,2-difluoropropyl)-6-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(2,2-difluoropropyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 157658787
3-(1,1-Difluoroethyl)-6-[2-methyl-5-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrimidine;2-[4-[3-(1-fluoroethyl)-[1,2,4]triazolo[4,3-a]pyrazin-6-yl]phenyl]-2-methylpropanenitrile;3-(1-fluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;6-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrimidine
CID 157831017
5-(1,1-Difluoroethyl)-3-[2-methyl-4-(trifluoromethoxy)phenyl]imidazo[1,5-b]pyridazine;1-(1,1-difluoroethyl)-7-[4-(trifluoromethoxy)phenyl]imidazo[1,5-a]pyridine;8-(1,1-difluoroethyl)-2-[4-(trifluoromethoxy)phenyl]imidazo[1,5-a]pyrimidine;1-(1,1-difluoroethyl)-7-[4-(trifluoromethoxy)phenyl]imidazo[1,5-c]pyrimidine;3-[2-methyl-4-(trifluoromethoxy)phenyl]pyrrolo[1,2-b]pyridazine;3-[2-methyl-4-(trifluoromethoxy)phenyl]pyrrolo[1,2-c]pyrimidine;7-[4-(trifluoromethoxy)phenyl]indolizine;2-[4-(trifluoromethoxy)phenyl]pyrrolo[1,2-a]pyrimidine;3-[4-(trifluoromethoxy)phenyl]pyrrolo[1,2-c]pyrimidine
CID 157854114
CID 158012332
CID 158012332
7-[1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-5-methylpyrazolo[3,4-b]pyridine;7-[1-(3,5-difluoro-4-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;7-[1-(3-fluoro-5-methylphenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]pyrazolo[3,4-b]pyridine;3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-5-methyl-7-[(1S)-1-(4-methylphenyl)ethyl]pyrazolo[3,4-b]pyridine;3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-7-[1-(4-methylphenyl)ethyl]-5-(trifluoromethyl)pyrazolo[3,4-b]pyridine
CID 158335812
10-[2,5-Bis[3-methyl-5-(trifluoromethyl)phenyl]-4-phenoxazin-10-ylphenyl]phenoxazine;9-[4-carbazol-9-yl-2,3-di(pyrimidin-2-yl)phenyl]carbazole;5-[3,6-di(carbazol-9-yl)-2-(3-cyano-5-isocyanophenyl)phenyl]benzene-1,3-dicarbonitrile;4-[3,6-di(carbazol-9-yl)-2-(4-isocyanophenyl)phenyl]benzonitrile
CID 158341768
4-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-5-yl)benzonitrile;5-(4-methoxyphenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;5-(3-methoxyphenyl)-N-(4-morpholin-4-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-5-(3-propan-2-ylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;4-[2-(4-morpholin-4-ylanilino)-[1,2,4]triazolo[1,5-a]pyridin-5-yl]benzonitrile;N-(4-morpholin-4-ylphenyl)-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 158581326
3-(1,1-Difluoroethyl)-6-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrimidine;3-(1,1-difluoroethyl)-6-[2-methyl-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrimidine;3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridine;2-methyl-6-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrimidine;2-methyl-6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine;6-[4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrazine;6-[4-(trifluoromethoxy)phenyl]imidazo[1,2-b]pyridazine
CID 159786004
3-[6-[4-(1,1-Difluoroethoxy)-2-methylphenyl]-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]benzonitrile;6-[4-(1,1-difluoroethoxy)phenyl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyrazine;3-(difluoromethyl)-6-(4-phenoxyphenyl)-[1,2,4]triazolo[4,3-a]pyrazine;6-[6-(2,2-difluoropropoxy)-3-pyridinyl]-3-propan-2-yl-[1,2,4]triazolo[4,3-b]pyridazine;6-(4-phenoxyphenyl)-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyrazine;6-(4-phenoxyphenyl)-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 160146151
3-[2-[4-(3,5-dimethyl-1,2,4-triazol-1-yl)-3-fluoroanilino]pyrimidin-4-yl]-5-morpholin-4-ylbenzonitrile;4-[3-(4-ethylpiperazin-1-yl)-5-fluorophenyl]-N-[4-[3-(6-methoxy-3-pyridinyl)-1,2,4-triazol-1-yl]phenyl]pyrimidin-2-amine;4-(3-fluoro-5-piperazin-1-ylphenyl)-N-[4-[3-(6-methoxy-3-pyridinyl)-1,2,4-triazol-1-yl]phenyl]pyrimidin-2-amine;3-[2-[4-[3-(6-methoxy-3-pyridinyl)-1,2,4-triazol-1-yl]anilino]pyrimidin-4-yl]-5-piperazin-1-ylbenzonitrile;3-piperazin-1-yl-5-[2-[4-[3-(trifluoromethyl)-1,2,4-triazol-1-yl]anilino]pyrimidin-4-yl]benzonitrile
CID 160195377

Frequently Asked Questions

What is the IUPAC name of 2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine (CID 158764840) is 2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine is COc1cc(-n2nnc(-c3ccccn3)n2)ccc1-n1ccc2cccnc21.COc1cc(-n2nnc(-c3ccccn3)n2)ccc1-n1cccn1.COc1ccc(C)cc1-c1cc(F)cc(-n2nnc(-c3ccccn3)n2)c1.FC(F)(F)Oc1cc(-n2nnc(-c3ccccn3)n2)ccc1-c1ccccn1.FC(F)(F)c1cc(-n2nnc(-c3ccccn3)n2)ccc1-c1ccccn1.Fc1cc(-n2nnc(-c3ccccn3)n2)ccc1-c1ccccn1.N#Cc1cc(-n2nnc(-c3ccccn3)n2)ccc1-c1ccccn1.
What is the InChIKey of 2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine?
The InChIKey is IPCXNKSZKWCRCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN5O.C20H15N7O.C18H11F3N6O.C18H11F3N6.C18H11N7.C17H11FN6.C16H13N7O/c1-13-6-7-19(27-2)17(9-13)14-10-15(21)12-16(11-14)26-24-20(23-25-26)18-5-3-4-8-22-18;1-28-18-13-15(27-24-19(23-25-27)16-6-2-3-10-21-16)7-8-17(18)26-12-9-14-5-4-11-22-20(14)26;19-18(20,21)28-16-11-12(7-8-13(16)14-5-1-3-9-22-14)27-25-17(24-26-27)15-6-2-4-10-23-15;19-18(20,21)14-11-12(7-8-13(14)15-5-1-3-9-22-15)27-25-17(24-26-27)16-6-2-4-10-23-16;19-12-13-11-14(7-8-15(13)16-5-1-3-9-20-16)25-23-18(22-24-25)17-6-2-4-10-21-17;18-14-11-12(7-8-13(14)15-5-1-3-9-19-15)24-22-17(21-23-24)16-6-2-4-10-20-16;1-24-15-11-12(6-7-14(15)22-10-4-9-18-22)23-20-16(19-21-23)13-5-2-3-8-17-13/h3-12H,1-2H3;2-13H,1H3;1-11H;1-11H;1-11H;1-11H;2-11H,1H3.
What are the key properties of 2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine?
2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine has a molecular weight of 2446.39 g/mol, XLogP of 21.91, 25 rotatable bonds, 0 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[3-fluoro-5-(2-methoxy-5-methylphenyl)phenyl]tetrazol-5-yl]pyridine;2-[2-(3-fluoro-4-pyridin-2-ylphenyl)tetrazol-5-yl]pyridine;2-[2-(3-methoxy-4-pyrazol-1-ylphenyl)tetrazol-5-yl]pyridine;1-[2-methoxy-4-(5-pyridin-2-yltetrazol-2-yl)phenyl]pyrrolo[2,3-b]pyridine;2-pyridin-2-yl-5-(5-pyridin-2-yltetrazol-2-yl)benzonitrile;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethoxy)phenyl]pyridine;2-[4-(5-pyridin-2-yltetrazol-2-yl)-2-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 158764840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).