6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine

C100H75Cl2F10N21O5 — CID 160875073

IUPAC6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESCC1(C)CC(Nc2ncnc3ccc(-c4cccnc4-c4ccc(F)c(Cl)c4)cc23)CC(C)(C)N1O.COc1ccc(Cl)cc1-c1ncccc1-c1ccn2ncnc2c1.FC(F)(F)Oc1cccc(-c2ncccc2-c2ccn3ncnc3c2)c1.FC(F)Oc1cccc(-c2ncccc2-c2ccn3ncnc3c2)c1.Fc1ccc(OC(F)(F)F)cc1-c1ncccc1-c1ccn2ncnc2c1
InChIInChI=1S/C28H29ClFN5O.C18H13ClN4O.C18H10F4N4O.C18H11F3N4O.C18H12F2N4O/c1-27(2)14-19(15-28(3,4)35(27)36)34-26-21-12-17(8-10-24(21)32-16-33-26)20-6-5-11-31-25(20)18-7-9-23(30)22(29)13-18;1-24-16-5-4-13(19)10-15(16)18-14(3-2-7-20-18)12-6-8-23-17(9-12)21-11-22-23;19-15-4-3-12(27-18(20,21)22)9-14(15)17-13(2-1-6-23-17)11-5-7-26-16(8-11)24-10-25-26;19-18(20,21)26-14-4-1-3-13(9-14)17-15(5-2-7-22-17)12-6-8-25-16(10-12)23-11-24-25;19-18(20)25-14-4-1-3-13(9-14)17-15(5-2-7-21-17)12-6-8-24-16(10-12)22-11-23-24/h5-13,16,19,36H,14-15H2,1-4H3,(H,32,33,34);2-11H,1H3;1-10H;1-11H;1-11,18H
InChIKeyGYSNPVYSEOMSQT-UHFFFAOYSA-N
MW1911.73 g/mol
LogP24.01
Rot. Bonds17

About 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine

6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 160875073) has the molecular formula C100H75Cl2F10N21O5 and a molecular weight of 1911.73 g/mol. Its IUPAC name is 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID160875073
Molecular FormulaC100H75Cl2F10N21O5
Molecular Weight1911.73 g/mol
Exact Mass1909.55
IUPAC Name6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESCC1(C)CC(Nc2ncnc3ccc(-c4cccnc4-c4ccc(F)c(Cl)c4)cc23)CC(C)(C)N1O.COc1ccc(Cl)cc1-c1ncccc1-c1ccn2ncnc2c1.FC(F)(F)Oc1cccc(-c2ncccc2-c2ccn3ncnc3c2)c1.FC(F)Oc1cccc(-c2ncccc2-c2ccn3ncnc3c2)c1.Fc1ccc(OC(F)(F)F)cc1-c1ncccc1-c1ccn2ncnc2c1
InChIInChI=1S/C28H29ClFN5O.C18H13ClN4O.C18H10F4N4O.C18H11F3N4O.C18H12F2N4O/c1-27(2)14-19(15-28(3,4)35(27)36)34-26-21-12-17(8-10-24(21)32-16-33-26)20-6-5-11-31-25(20)18-7-9-23(30)22(29)13-18;1-24-16-5-4-13(19)10-15(16)18-14(3-2-7-20-18)12-6-8-23-17(9-12)21-11-22-23;19-15-4-3-12(27-18(20,21)22)9-14(15)17-13(2-1-6-23-17)11-5-7-26-16(8-11)24-10-25-26;19-18(20,21)26-14-4-1-3-13(9-14)17-15(5-2-7-22-17)12-6-8-25-16(10-12)23-11-24-25;19-18(20)25-14-4-1-3-13(9-14)17-15(5-2-7-21-17)12-6-8-24-16(10-12)22-11-23-24/h5-13,16,19,36H,14-15H2,1-4H3,(H,32,33,34);2-11H,1H3;1-10H;1-11H;1-11,18H
InChIKeyGYSNPVYSEOMSQT-UHFFFAOYSA-N
XLogP24.01
TPSA283.41 Ų
H-Bond Donors2
H-Bond Acceptors26
Rotatable Bonds17
Heavy Atoms138
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001911.73
LogP ≤ 524.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1026

Analyze 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine with MolForge

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Related Compounds

N-(3,5-difluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3-fluorophenyl)-8-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(2-fluorophenyl)-N-phenyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3-fluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(4-fluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-phenyl-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 157307599
3-[4-amino-1-[(2-chloroquinolin-3-yl)methyl]pyrazolo[3,4-d]pyrimidin-3-yl]-5-fluorophenol;3-[4-amino-1-[[2-[methyl(propan-2-yl)amino]quinolin-3-yl]methyl]pyrazolo[3,4-d]pyrimidin-3-yl]-5-fluorophenol;3-[4-amino-1-[(2-pyridin-3-ylquinolin-3-yl)methyl]pyrazolo[3,4-d]pyrimidin-3-yl]-5-fluorophenol;(2R)-4-[4-amino-1-[[2-[2-(trifluoromethyl)phenyl]quinolin-3-yl]methyl]pyrazolo[3,4-d]pyrimidin-3-yl]but-3-yn-2-ol
CID 158041322
[4-chloro-3-[[[(2S)-3,3-difluorobutan-2-yl]amino]methyl]-2-methoxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;[4-chloro-3-[[4-[3-(1,1-difluoroethyl)pyrazol-1-yl]piperidin-1-yl]methyl]-2-methoxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;[4-chloro-3-[(4,4-difluoropentylamino)methyl]-2-methoxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;[4-chloro-2-methoxy-3-[(3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)methyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol
CID 158270317
6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-methylquinazolin-4-amine;7-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-1-methylquinoxalin-2-one;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 158323258
7-[2-(5-Chloro-2,4-difluorophenyl)-5-fluoro-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(3-chloro-4-fluorophenyl)-5-fluoro-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(5-chloro-2-fluorophenyl)-5-fluoro-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(5-chloro-2-fluorophenyl)-5-methoxy-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[5-fluoro-2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[5-methoxy-2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 158374401
4-chloro-6-(5-methoxy-2-methylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine;6-(2-ethyl-5-fluoropyrazolo[1,5-a]pyridin-3-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;6-(6-fluoro-2-methylbenzimidazol-1-yl)-3-hydroxy-2-N-[4-(trifluoromethyl)phenyl]pyrimidin-3-ium-2,4-diamine;6-(5-fluoro-2-methylpyrazolo[1,5-a]pyridin-3-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;3-hydroxy-6-(2-methylbenzimidazol-1-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidin-3-ium-2,4-diamine;6-(5-methoxy-2-methylpyrazolo[1,5-a]pyridin-3-yl)-2-N-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 159269104
6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(3-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 160142680
7-[2-(5-Chloro-2,4-difluorophenyl)-5-fluoro-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(3-chloro-4-fluorophenyl)-5-fluoro-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(5-chloro-2-fluorophenyl)-5-fluoro-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(5-chloro-2-fluorophenyl)-5-methoxy-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[5-methoxy-2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 160332880
7-[2-(5-Chloro-2,4-difluorophenyl)-5-fluoro-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(5-chloro-2,4-difluorophenyl)-5-methoxy-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(3-chloro-4-fluorophenyl)-5-fluoro-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(5-chloro-2-fluorophenyl)-5-methoxy-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[5-methoxy-2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 160440094
2-[4-[[3-(3-Chlorophenyl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexyl]propan-2-ol;2-[4-[[3-(3-methylphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]amino]cyclohexyl]propan-2-ol;2-[4-[[3-[3-(trifluoromethoxy)phenyl]imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexyl]propan-2-ol;4-[[3-[3-(trifluoromethyl)phenyl]imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-ol;2-[4-[[3-[3-(trifluoromethyl)phenyl]imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexyl]propan-2-ol
CID 160934089
7-[2-(5-Chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(2-chloro-5-methylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(4,5-difluoro-2-methylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(3-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-methyl-5-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(3,4,5-trifluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 161111872
6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-methylquinazolin-4-amine;7-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-1-methylquinoxalin-2-one;7-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methylquinoxalin-2-one;7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-1-methylquinoxalin-2-one;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 161473203

Frequently Asked Questions

What is the IUPAC name of 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine (CID 160875073) is 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine is CC1(C)CC(Nc2ncnc3ccc(-c4cccnc4-c4ccc(F)c(Cl)c4)cc23)CC(C)(C)N1O.COc1ccc(Cl)cc1-c1ncccc1-c1ccn2ncnc2c1.FC(F)(F)Oc1cccc(-c2ncccc2-c2ccn3ncnc3c2)c1.FC(F)Oc1cccc(-c2ncccc2-c2ccn3ncnc3c2)c1.Fc1ccc(OC(F)(F)F)cc1-c1ncccc1-c1ccn2ncnc2c1.
What is the InChIKey of 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is GYSNPVYSEOMSQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H29ClFN5O.C18H13ClN4O.C18H10F4N4O.C18H11F3N4O.C18H12F2N4O/c1-27(2)14-19(15-28(3,4)35(27)36)34-26-21-12-17(8-10-24(21)32-16-33-26)20-6-5-11-31-25(20)18-7-9-23(30)22(29)13-18;1-24-16-5-4-13(19)10-15(16)18-14(3-2-7-20-18)12-6-8-23-17(9-12)21-11-22-23;19-15-4-3-12(27-18(20,21)22)9-14(15)17-13(2-1-6-23-17)11-5-7-26-16(8-11)24-10-25-26;19-18(20,21)26-14-4-1-3-13(9-14)17-15(5-2-7-22-17)12-6-8-25-16(10-12)23-11-24-25;19-18(20)25-14-4-1-3-13(9-14)17-15(5-2-7-21-17)12-6-8-24-16(10-12)22-11-23-24/h5-13,16,19,36H,14-15H2,1-4H3,(H,32,33,34);2-11H,1H3;1-10H;1-11H;1-11,18H.
What are the key properties of 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine?
6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 1911.73 g/mol, XLogP of 24.01, 17 rotatable bonds, 2 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-N-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)quinazolin-4-amine;7-[2-(5-chloro-2-methoxyphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(difluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[2-fluoro-5-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-[3-(trifluoromethoxy)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 160875073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).