4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine

C181H137Cl2F4N59O5 — CID 161464849

IUPAC4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
SMILESCOc1ccc(-c2c(-c3ccccc3)nc(N)n3ncnc23)cc1Cl.Cc1cc(-c2c(-c3ccccc3)nc(N)n3ncnc23)cc(C)n1.Cc1cc(-c2c(-c3ccccc3)nc(N)n3ncnc23)cc2cn[nH]c12.Cc1cc(-c2c(-c3ccccc3)nc(N)n3ncnc23)ccc1F.Cc1cc(-c2c(-c3ccccc3)nc(N)n3ncnc23)ccc1O.Nc1nc(-c2ccccc2)c(-c2ccc(O)c(Cl)c2)c2ncnn12.Nc1nc(-c2ccccc2)c(-c2ccc3[nH]ncc3c2)c2ncnn12.Nc1nc(-c2ccccc2)c(-c2ccc3c(c2)OCO3)c2ncnn12.Nc1nc(-c2ccccc2)c(-c2ccc3n[nH]c(C(F)(F)F)c3c2)c2ncnn12.Nc1nc(-c2ccccc2)c(-c2ccc3nc[nH]c3c2)c2ncnn12
InChIInChI=1S/C19H12F3N7.C19H15N7.C18H14ClN5O.C18H14FN5.2C18H13N7.C18H16N6.C18H13N5O2.C18H15N5O.C17H12ClN5O/c20-19(21,22)16-12-8-11(6-7-13(12)27-28-16)14-15(10-4-2-1-3-5-10)26-18(23)29-17(14)24-9-25-29;1-11-7-13(8-14-9-22-25-16(11)14)15-17(12-5-3-2-4-6-12)24-19(20)26-18(15)21-10-23-26;1-25-14-8-7-12(9-13(14)19)15-16(11-5-3-2-4-6-11)23-18(20)24-17(15)21-10-22-24;1-11-9-13(7-8-14(11)19)15-16(12-5-3-2-4-6-12)23-18(20)24-17(15)21-10-22-24;19-18-23-16(11-4-2-1-3-5-11)15(17-20-10-22-25(17)18)12-6-7-14-13(8-12)9-21-24-14;19-18-24-16(11-4-2-1-3-5-11)15(17-22-10-23-25(17)18)12-6-7-13-14(8-12)21-9-20-13;1-11-8-14(9-12(2)22-11)15-16(13-6-4-3-5-7-13)23-18(19)24-17(15)20-10-21-24;19-18-22-16(11-4-2-1-3-5-11)15(17-20-9-21-23(17)18)12-6-7-13-14(8-12)25-10-24-13;1-11-9-13(7-8-14(11)24)15-16(12-5-3-2-4-6-12)22-18(19)23-17(15)20-10-21-23;18-12-8-11(6-7-13(12)24)14-15(10-4-2-1-3-5-10)22-17(19)23-16(14)20-9-21-23/h1-9H,(H2,23,26)(H,27,28);2-10H,1H3,(H2,20,24)(H,22,25);2-10H,1H3,(H2,20,23);2-10H,1H3,(H2,20,23);1-10H,(H2,19,23)(H,21,24);1-10H,(H2,19,24)(H,20,21);3-10H,1-2H3,(H2,19,23);1-9H,10H2,(H2,19,22);2-10,24H,1H3,(H2,19,22);1-9,24H,(H2,19,22)
InChIKeyWCHDPSYMPVRRSH-UHFFFAOYSA-N
MW3365.39 g/mol
LogP32.46
Rot. Bonds21

About 4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine

4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine (PubChem CID 161464849) has the molecular formula C181H137Cl2F4N59O5 and a molecular weight of 3365.39 g/mol. Its IUPAC name is 4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine.

Molecular Properties

Compound Name4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
PubChem CID161464849
Molecular FormulaC181H137Cl2F4N59O5
Molecular Weight3365.39 g/mol
Exact Mass3362.16
IUPAC Name4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
SMILESCOc1ccc(-c2c(-c3ccccc3)nc(N)n3ncnc23)cc1Cl.Cc1cc(-c2c(-c3ccccc3)nc(N)n3ncnc23)cc(C)n1.Cc1cc(-c2c(-c3ccccc3)nc(N)n3ncnc23)cc2cn[nH]c12.Cc1cc(-c2c(-c3ccccc3)nc(N)n3ncnc23)ccc1F.Cc1cc(-c2c(-c3ccccc3)nc(N)n3ncnc23)ccc1O.Nc1nc(-c2ccccc2)c(-c2ccc(O)c(Cl)c2)c2ncnn12.Nc1nc(-c2ccccc2)c(-c2ccc3[nH]ncc3c2)c2ncnn12.Nc1nc(-c2ccccc2)c(-c2ccc3c(c2)OCO3)c2ncnn12.Nc1nc(-c2ccccc2)c(-c2ccc3n[nH]c(C(F)(F)F)c3c2)c2ncnn12.Nc1nc(-c2ccccc2)c(-c2ccc3nc[nH]c3c2)c2ncnn12
InChIInChI=1S/C19H12F3N7.C19H15N7.C18H14ClN5O.C18H14FN5.2C18H13N7.C18H16N6.C18H13N5O2.C18H15N5O.C17H12ClN5O/c20-19(21,22)16-12-8-11(6-7-13(12)27-28-16)14-15(10-4-2-1-3-5-10)26-18(23)29-17(14)24-9-25-29;1-11-7-13(8-14-9-22-25-16(11)14)15-17(12-5-3-2-4-6-12)24-19(20)26-18(15)21-10-23-26;1-25-14-8-7-12(9-13(14)19)15-16(11-5-3-2-4-6-11)23-18(20)24-17(15)21-10-22-24;1-11-9-13(7-8-14(11)19)15-16(12-5-3-2-4-6-12)23-18(20)24-17(15)21-10-22-24;19-18-23-16(11-4-2-1-3-5-11)15(17-20-10-22-25(17)18)12-6-7-14-13(8-12)9-21-24-14;19-18-24-16(11-4-2-1-3-5-11)15(17-22-10-23-25(17)18)12-6-7-13-14(8-12)21-9-20-13;1-11-8-14(9-12(2)22-11)15-16(13-6-4-3-5-7-13)23-18(19)24-17(15)20-10-21-24;19-18-22-16(11-4-2-1-3-5-11)15(17-20-9-21-23(17)18)12-6-7-13-14(8-12)25-10-24-13;1-11-9-13(7-8-14(11)24)15-16(12-5-3-2-4-6-12)22-18(19)23-17(15)20-10-21-23;18-12-8-11(6-7-13(12)24)14-15(10-4-2-1-3-5-10)22-17(19)23-16(14)20-9-21-23/h1-9H,(H2,23,26)(H,27,28);2-10H,1H3,(H2,20,24)(H,22,25);2-10H,1H3,(H2,20,23);2-10H,1H3,(H2,20,23);1-10H,(H2,19,23)(H,21,24);1-10H,(H2,19,24)(H,20,21);3-10H,1-2H3,(H2,19,23);1-9H,10H2,(H2,19,22);2-10,24H,1H3,(H2,19,22);1-9,24H,(H2,19,22)
InChIKeyWCHDPSYMPVRRSH-UHFFFAOYSA-N
XLogP32.46
TPSA886.76 Ų
H-Bond Donors16
H-Bond Acceptors60
Rotatable Bonds21
Heavy Atoms251
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003365.39
LogP ≤ 532.46
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1060

Analyze 4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine with MolForge

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Related Compounds

1-chloro-3,5-dimethylbenzene;2-chloro-4,6-dimethylpyridine;2-chloro-1-methoxy-4-methylbenzene;2-chloro-4-methylphenol;2-chloro-4-methyl-6-(trifluoromethyl)pyridine;2-cyclopropyl-4-methyl-6-(trifluoromethyl)pyridine;2,6-dichloro-4-methylphenol;2,4-dimethylphenol;2,4-dimethyl-6-(trifluoromethyl)pyridine;2-ethyl-4-methyl-6-(trifluoromethyl)pyridine;1-fluoro-2,4-dimethylbenzene;2-methoxy-4,6-dimethylpyridine;2-methoxy-4-methylpyridine;6-methyl-1H-benzimidazole;5-methyl-1,3-benzodioxole;5-methyl-1H-indazole;4-methylpiperidine;4-methyl-2-propan-2-yl-6-(trifluoromethyl)pyridine;5-methyl-3-(trifluoromethyl)-2H-indazole;2,4,6-trimethyl-3,6-dihydro-2H-pyran;2,4,6-trimethyloxane;2,4,6-trimethylpyridine
CID 157972449
N-benzyl-4-[3-chloro-5-(trifluoromethyl)phenyl]-1-pyrimidin-2-yl-3-(trifluoromethyl)pyrazol-5-amine;2-[4-(7-chloro-1,3-benzodioxol-5-yl)-5-(2-phenylethyl)-3-(trifluoromethyl)pyrazol-1-yl]pyrimidine;N-[(4-chlorophenyl)methyl]-4-[3-chloro-5-(trifluoromethyl)phenyl]-1-pyrimidin-2-yl-3-(trifluoromethyl)pyrazol-5-amine;4-[3-chloro-5-(trifluoromethyl)phenyl]-N-[(4-methoxyphenyl)methyl]-1-pyrimidin-2-yl-3-(trifluoromethyl)pyrazol-5-amine
CID 160450721
N-(5-chloro-8-fluoronaphthalen-2-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(2,5-dimethylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;4-fluoro-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-ol;1-(2-methylpyrazol-3-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-1H-indazol-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 162116092
3-(7-amino-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)-5-fluorophenol;4-(7-amino-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)-2-fluorophenol;5-(3,4-dimethoxyphenyl)-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(1-methylpyrazol-4-yl)-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;5-(1H-pyrazol-4-yl)-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 157393441
4-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)benzene-1,2-diol;3-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)-4-chlorophenol;5-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)-2-chlorophenol;3-(4-aminophenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3,4-dimethylphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(2-methyl-3H-benzimidazol-5-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-methyl-2H-indazol-5-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-methyl-1H-indol-6-yl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 157520854
2-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)-5-fluorophenol;4-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)phenol;3-(3-aminophenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3,13-dimethyl-4,5,7,9,11,13,14-heptazatetracyclo[6.6.1.02,6.012,15]pentadeca-1,3,5,8(15),9,11-hexaene;3-(3-fluoro-5-methoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-methyl-2H-indazol-6-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-methyl-1H-indol-5-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 157740327
3-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)-5-chlorophenol;2-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)-5-fluorophenol;4-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)phenol;3-(3,5-dimethyl-1H-pyrazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(3-fluoro-5-methoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(1H-indazol-4-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-methyl-2H-indazol-6-yl)pyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 158587616
2-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3,5-difluorophenol;3-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-2,4-difluorophenol;4-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-3,5-difluorophenol;3-[3-(1H-benzimidazol-2-yl)-1H-indazol-5-yl]-2-methoxyphenol;3-(1H-benzimidazol-2-yl)-5-(1H-indol-4-yl)-1H-indazole;5-(4-chloro-5-ethyl-3-pyridinyl)-3-[(E)-2-phenylethenyl]-1H-indazole
CID 158759167
3-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)-5-chlorophenol;3-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)-5-fluorophenol;4-(4-amino-1-methylpyrazolo[3,4-d]pyrimidin-3-yl)-2-fluorophenol;3-(3-fluoro-5-methoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;3-(1H-indazol-6-yl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine;1-methyl-3-(3-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 159412430
4-N-[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-3-yl]-2-N-[1-(2,4-difluorophenyl)ethyl]-1,3,5-triazine-2,4-diamine;2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;2-N-[1-(2,4-difluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;2-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine
CID 159964486
4-N-[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-3-yl]-2-N-[1-(4-fluorophenyl)ethyl]-1,3,5-triazine-2,4-diamine;4-N-[5-(3,4-dimethoxyphenyl)-1H-pyrazol-3-yl]-2-N-[1-(4-fluorophenyl)ethyl]-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[5-(2-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[5-(3-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;2-N-[1-(4-fluorophenyl)ethyl]-4-N-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;2-N-[(1S)-1-(4-fluorophenyl)ethyl]-4-N-(5-quinoxalin-6-yl-1H-pyrazol-3-yl)-1,3,5-triazine-2,4-diamine
CID 160401429
2-[4-(1,3-benzodioxol-5-yl)-2-tert-butyl-1H-imidazol-5-yl]-6-methylpyridine;6-[2-tert-butyl-5-(6-methyl-2-pyridinyl)-1H-imidazol-4-yl]quinoxaline;2-(5-chloro-2-fluorophenyl)-N-pyridin-4-ylpteridin-4-amine;2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine;4-(5-pyridin-2-yl-1H-pyrazol-4-yl)quinoline
CID 160411043

Frequently Asked Questions

What is the IUPAC name of 4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
The IUPAC name of 4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine (CID 161464849) is 4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine.
What is the SMILES notation for 4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
The canonical SMILES for 4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine is COc1ccc(-c2c(-c3ccccc3)nc(N)n3ncnc23)cc1Cl.Cc1cc(-c2c(-c3ccccc3)nc(N)n3ncnc23)cc(C)n1.Cc1cc(-c2c(-c3ccccc3)nc(N)n3ncnc23)cc2cn[nH]c12.Cc1cc(-c2c(-c3ccccc3)nc(N)n3ncnc23)ccc1F.Cc1cc(-c2c(-c3ccccc3)nc(N)n3ncnc23)ccc1O.Nc1nc(-c2ccccc2)c(-c2ccc(O)c(Cl)c2)c2ncnn12.Nc1nc(-c2ccccc2)c(-c2ccc3[nH]ncc3c2)c2ncnn12.Nc1nc(-c2ccccc2)c(-c2ccc3c(c2)OCO3)c2ncnn12.Nc1nc(-c2ccccc2)c(-c2ccc3n[nH]c(C(F)(F)F)c3c2)c2ncnn12.Nc1nc(-c2ccccc2)c(-c2ccc3nc[nH]c3c2)c2ncnn12.
What is the InChIKey of 4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
The InChIKey is WCHDPSYMPVRRSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F3N7.C19H15N7.C18H14ClN5O.C18H14FN5.2C18H13N7.C18H16N6.C18H13N5O2.C18H15N5O.C17H12ClN5O/c20-19(21,22)16-12-8-11(6-7-13(12)27-28-16)14-15(10-4-2-1-3-5-10)26-18(23)29-17(14)24-9-25-29;1-11-7-13(8-14-9-22-25-16(11)14)15-17(12-5-3-2-4-6-12)24-19(20)26-18(15)21-10-23-26;1-25-14-8-7-12(9-13(14)19)15-16(11-5-3-2-4-6-11)23-18(20)24-17(15)21-10-22-24;1-11-9-13(7-8-14(11)19)15-16(12-5-3-2-4-6-12)23-18(20)24-17(15)21-10-22-24;19-18-23-16(11-4-2-1-3-5-11)15(17-20-10-22-25(17)18)12-6-7-14-13(8-12)9-21-24-14;19-18-24-16(11-4-2-1-3-5-11)15(17-22-10-23-25(17)18)12-6-7-13-14(8-12)21-9-20-13;1-11-8-14(9-12(2)22-11)15-16(13-6-4-3-5-7-13)23-18(19)24-17(15)20-10-21-24;19-18-22-16(11-4-2-1-3-5-11)15(17-20-9-21-23(17)18)12-6-7-13-14(8-12)25-10-24-13;1-11-9-13(7-8-14(11)24)15-16(12-5-3-2-4-6-12)22-18(19)23-17(15)20-10-21-23;18-12-8-11(6-7-13(12)24)14-15(10-4-2-1-3-5-10)22-17(19)23-16(14)20-9-21-23/h1-9H,(H2,23,26)(H,27,28);2-10H,1H3,(H2,20,24)(H,22,25);2-10H,1H3,(H2,20,23);2-10H,1H3,(H2,20,23);1-10H,(H2,19,23)(H,21,24);1-10H,(H2,19,24)(H,20,21);3-10H,1-2H3,(H2,19,23);1-9H,10H2,(H2,19,22);2-10,24H,1H3,(H2,19,22);1-9,24H,(H2,19,22).
What are the key properties of 4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine has a molecular weight of 3365.39 g/mol, XLogP of 32.46, 21 rotatable bonds, 16 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-chlorophenol;4-(5-amino-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-8-yl)-2-methylphenol;8-(3H-benzimidazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1,3-benzodioxol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(3-chloro-4-methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(2,6-dimethyl-4-pyridinyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(4-fluoro-3-methylphenyl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;8-(7-methyl-1H-indazol-5-yl)-7-phenyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine;7-phenyl-8-[3-(trifluoromethyl)-2H-indazol-5-yl]-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine is sourced from PubChem (CID 161464849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).