N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine

C171H153ClF2N40O8 — CID 158704764

IUPACN-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine
SMILESCc1c(F)ccc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)c1C.Cc1cc(C)cc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)c1.Cc1cc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)cc(C)c1Cl.Cc1cc(Oc2ccc(-c3nc(Nc4ccc(F)c(C)c4C)n[nH]3)cc2)ccn1.Cc1cc(Oc2ccc(-c3nc(Nc4cccc(C)c4C)n[nH]3)cc2)ccn1.Cc1ccc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)cc1C.Cc1cccc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)c1.c1cc2c(c(Nc3n[nH]c(-c4ccc(Oc5ccncc5)cc4)n3)c1)CCCC2
InChIInChI=1S/C23H21N5O.C22H20FN5O.C22H21N5O.C21H18ClN5O.C21H18FN5O.2C21H19N5O.C20H17N5O/c1-2-6-20-16(4-1)5-3-7-21(20)25-23-26-22(27-28-23)17-8-10-18(11-9-17)29-19-12-14-24-15-13-19;1-13-12-18(10-11-24-13)29-17-6-4-16(5-7-17)21-26-22(28-27-21)25-20-9-8-19(23)14(2)15(20)3;1-14-5-4-6-20(16(14)3)24-22-25-21(26-27-22)17-7-9-18(10-8-17)28-19-11-12-23-15(2)13-19;1-13-11-16(12-14(2)19(13)22)24-21-25-20(26-27-21)15-3-5-17(6-4-15)28-18-7-9-23-10-8-18;1-13-14(2)19(8-7-18(13)22)24-21-25-20(26-27-21)15-3-5-16(6-4-15)28-17-9-11-23-12-10-17;1-14-3-6-17(13-15(14)2)23-21-24-20(25-26-21)16-4-7-18(8-5-16)27-19-9-11-22-12-10-19;1-14-11-15(2)13-17(12-14)23-21-24-20(25-26-21)16-3-5-18(6-4-16)27-19-7-9-22-10-8-19;1-14-3-2-4-16(13-14)22-20-23-19(24-25-20)15-5-7-17(8-6-15)26-18-9-11-21-12-10-18/h3,5,7-15H,1-2,4,6H2,(H2,25,26,27,28);4-12H,1-3H3,(H2,25,26,27,28);4-13H,1-3H3,(H2,24,25,26,27);2*3-12H,1-2H3,(H2,24,25,26,27);2*3-13H,1-2H3,(H2,23,24,25,26);2-13H,1H3,(H2,22,23,24,25)
InChIKeyIHZBCUIXGOYWHX-UHFFFAOYSA-N
MW2969.83 g/mol
LogP41.66
Rot. Bonds40

About N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine

N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine (PubChem CID 158704764) has the molecular formula C171H153ClF2N40O8 and a molecular weight of 2969.83 g/mol. Its IUPAC name is N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine.

Molecular Properties

Compound NameN-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine
PubChem CID158704764
Molecular FormulaC171H153ClF2N40O8
Molecular Weight2969.83 g/mol
Exact Mass2967.25
IUPAC NameN-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine
SMILESCc1c(F)ccc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)c1C.Cc1cc(C)cc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)c1.Cc1cc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)cc(C)c1Cl.Cc1cc(Oc2ccc(-c3nc(Nc4ccc(F)c(C)c4C)n[nH]3)cc2)ccn1.Cc1cc(Oc2ccc(-c3nc(Nc4cccc(C)c4C)n[nH]3)cc2)ccn1.Cc1ccc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)cc1C.Cc1cccc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)c1.c1cc2c(c(Nc3n[nH]c(-c4ccc(Oc5ccncc5)cc4)n3)c1)CCCC2
InChIInChI=1S/C23H21N5O.C22H20FN5O.C22H21N5O.C21H18ClN5O.C21H18FN5O.2C21H19N5O.C20H17N5O/c1-2-6-20-16(4-1)5-3-7-21(20)25-23-26-22(27-28-23)17-8-10-18(11-9-17)29-19-12-14-24-15-13-19;1-13-12-18(10-11-24-13)29-17-6-4-16(5-7-17)21-26-22(28-27-21)25-20-9-8-19(23)14(2)15(20)3;1-14-5-4-6-20(16(14)3)24-22-25-21(26-27-22)17-7-9-18(10-8-17)28-19-11-12-23-15(2)13-19;1-13-11-16(12-14(2)19(13)22)24-21-25-20(26-27-21)15-3-5-17(6-4-15)28-18-7-9-23-10-8-18;1-13-14(2)19(8-7-18(13)22)24-21-25-20(26-27-21)15-3-5-16(6-4-15)28-17-9-11-23-12-10-17;1-14-3-6-17(13-15(14)2)23-21-24-20(25-26-21)16-4-7-18(8-5-16)27-19-9-11-22-12-10-19;1-14-11-15(2)13-17(12-14)23-21-24-20(25-26-21)16-3-5-18(6-4-16)27-19-7-9-22-10-8-19;1-14-3-2-4-16(13-14)22-20-23-19(24-25-20)15-5-7-17(8-6-15)26-18-9-11-21-12-10-18/h3,5,7-15H,1-2,4,6H2,(H2,25,26,27,28);4-12H,1-3H3,(H2,25,26,27,28);4-13H,1-3H3,(H2,24,25,26,27);2*3-12H,1-2H3,(H2,24,25,26,27);2*3-13H,1-2H3,(H2,23,24,25,26);2-13H,1H3,(H2,22,23,24,25)
InChIKeyIHZBCUIXGOYWHX-UHFFFAOYSA-N
XLogP41.66
TPSA605.76 Ų
H-Bond Donors16
H-Bond Acceptors40
Rotatable Bonds40
Heavy Atoms222
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002969.83
LogP ≤ 541.66
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1040

Analyze N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine?
The IUPAC name of N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine (CID 158704764) is N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine.
What is the SMILES notation for N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine?
The canonical SMILES for N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine is Cc1c(F)ccc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)c1C.Cc1cc(C)cc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)c1.Cc1cc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)cc(C)c1Cl.Cc1cc(Oc2ccc(-c3nc(Nc4ccc(F)c(C)c4C)n[nH]3)cc2)ccn1.Cc1cc(Oc2ccc(-c3nc(Nc4cccc(C)c4C)n[nH]3)cc2)ccn1.Cc1ccc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)cc1C.Cc1cccc(Nc2n[nH]c(-c3ccc(Oc4ccncc4)cc3)n2)c1.c1cc2c(c(Nc3n[nH]c(-c4ccc(Oc5ccncc5)cc4)n3)c1)CCCC2.
What is the InChIKey of N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine?
The InChIKey is IHZBCUIXGOYWHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5O.C22H20FN5O.C22H21N5O.C21H18ClN5O.C21H18FN5O.2C21H19N5O.C20H17N5O/c1-2-6-20-16(4-1)5-3-7-21(20)25-23-26-22(27-28-23)17-8-10-18(11-9-17)29-19-12-14-24-15-13-19;1-13-12-18(10-11-24-13)29-17-6-4-16(5-7-17)21-26-22(28-27-21)25-20-9-8-19(23)14(2)15(20)3;1-14-5-4-6-20(16(14)3)24-22-25-21(26-27-22)17-7-9-18(10-8-17)28-19-11-12-23-15(2)13-19;1-13-11-16(12-14(2)19(13)22)24-21-25-20(26-27-21)15-3-5-17(6-4-15)28-18-7-9-23-10-8-18;1-13-14(2)19(8-7-18(13)22)24-21-25-20(26-27-21)15-3-5-16(6-4-15)28-17-9-11-23-12-10-17;1-14-3-6-17(13-15(14)2)23-21-24-20(25-26-21)16-4-7-18(8-5-16)27-19-9-11-22-12-10-19;1-14-11-15(2)13-17(12-14)23-21-24-20(25-26-21)16-3-5-18(6-4-16)27-19-7-9-22-10-8-19;1-14-3-2-4-16(13-14)22-20-23-19(24-25-20)15-5-7-17(8-6-15)26-18-9-11-21-12-10-18/h3,5,7-15H,1-2,4,6H2,(H2,25,26,27,28);4-12H,1-3H3,(H2,25,26,27,28);4-13H,1-3H3,(H2,24,25,26,27);2*3-12H,1-2H3,(H2,24,25,26,27);2*3-13H,1-2H3,(H2,23,24,25,26);2-13H,1H3,(H2,22,23,24,25).
What are the key properties of N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine?
N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine has a molecular weight of 2969.83 g/mol, XLogP of 41.66, 40 rotatable bonds, 16 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(3,4-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3,5-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-[4-[(2-methyl-4-pyridinyl)oxy]phenyl]-1H-1,2,4-triazol-3-amine;N-(4-fluoro-2,3-dimethylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;N-(3-methylphenyl)-5-(4-pyridin-4-yloxyphenyl)-1H-1,2,4-triazol-3-amine;5-(4-pyridin-4-yloxyphenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1H-1,2,4-triazol-3-amine is sourced from PubChem (CID 158704764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).