About 2-N,3-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]naphthalene-2,3-dicarboxamide;3-N,4-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]thiophene-3,4-dicarboxamide;[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl] N-[6-[[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl]oxymethylamino]-1,3-benzothiazol-5-yl]methanimidate;[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl] N-[4,5-bis[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazole-5-carbonyl]amino]-2-[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]oxymethylamino]phenyl]methanimidate;2-[5-[[3-[[2-(2-hydroxy-5-methylphenyl)benzotriazol-5-yl]oxymethylamino]anilino]methoxy]benzotriazol-2-yl]-4,6-dimethylphenol
2-N,3-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]naphthalene-2,3-dicarboxamide;3-N,4-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]thiophene-3,4-dicarboxamide;[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl] N-[6-[[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl]oxymethylamino]-1,3-benzothiazol-5-yl]methanimidate;[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl] N-[4,5-bis[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazole-5-carbonyl]amino]-2-[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]oxymethylamino]phenyl]methanimidate;2-[5-[[3-[[2-(2-hydroxy-5-methylphenyl)benzotriazol-5-yl]oxymethylamino]anilino]methoxy]benzotriazol-2-yl]-4,6-dimethylphenol (PubChem CID 157079169) has the molecular formula C210H175N49O26S2
and a molecular weight of 3865.16 g/mol. Its IUPAC name is 2-N,3-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]naphthalene-2,3-dicarboxamide;3-N,4-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]thiophene-3,4-dicarboxamide;[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl] N-[6-[[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl]oxymethylamino]-1,3-benzothiazol-5-yl]methanimidate;[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl] N-[4,5-bis[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazole-5-carbonyl]amino]-2-[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]oxymethylamino]phenyl]methanimidate;2-[5-[[3-[[2-(2-hydroxy-5-methylphenyl)benzotriazol-5-yl]oxymethylamino]anilino]methoxy]benzotriazol-2-yl]-4,6-dimethylphenol.
Frequently Asked Questions
What is the IUPAC name of 2-N,3-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]naphthalene-2,3-dicarboxamide;3-N,4-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]thiophene-3,4-dicarboxamide;[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl] N-[6-[[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl]oxymethylamino]-1,3-benzothiazol-5-yl]methanimidate;[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl] N-[4,5-bis[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazole-5-carbonyl]amino]-2-[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]oxymethylamino]phenyl]methanimidate;2-[5-[[3-[[2-(2-hydroxy-5-methylphenyl)benzotriazol-5-yl]oxymethylamino]anilino]methoxy]benzotriazol-2-yl]-4,6-dimethylphenol?
The IUPAC name of 2-N,3-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]naphthalene-2,3-dicarboxamide;3-N,4-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]thiophene-3,4-dicarboxamide;[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl] N-[6-[[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl]oxymethylamino]-1,3-benzothiazol-5-yl]methanimidate;[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl] N-[4,5-bis[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazole-5-carbonyl]amino]-2-[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]oxymethylamino]phenyl]methanimidate;2-[5-[[3-[[2-(2-hydroxy-5-methylphenyl)benzotriazol-5-yl]oxymethylamino]anilino]methoxy]benzotriazol-2-yl]-4,6-dimethylphenol (CID 157079169) is 2-N,3-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]naphthalene-2,3-dicarboxamide;3-N,4-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]thiophene-3,4-dicarboxamide;[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl] N-[6-[[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl]oxymethylamino]-1,3-benzothiazol-5-yl]methanimidate;[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl] N-[4,5-bis[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazole-5-carbonyl]amino]-2-[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]oxymethylamino]phenyl]methanimidate;2-[5-[[3-[[2-(2-hydroxy-5-methylphenyl)benzotriazol-5-yl]oxymethylamino]anilino]methoxy]benzotriazol-2-yl]-4,6-dimethylphenol.
What is the SMILES notation for 2-N,3-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]naphthalene-2,3-dicarboxamide;3-N,4-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]thiophene-3,4-dicarboxamide;[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl] N-[6-[[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl]oxymethylamino]-1,3-benzothiazol-5-yl]methanimidate;[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl] N-[4,5-bis[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazole-5-carbonyl]amino]-2-[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]oxymethylamino]phenyl]methanimidate;2-[5-[[3-[[2-(2-hydroxy-5-methylphenyl)benzotriazol-5-yl]oxymethylamino]anilino]methoxy]benzotriazol-2-yl]-4,6-dimethylphenol?
The canonical SMILES for 2-N,3-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]naphthalene-2,3-dicarboxamide;3-N,4-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]thiophene-3,4-dicarboxamide;[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl] N-[6-[[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl]oxymethylamino]-1,3-benzothiazol-5-yl]methanimidate;[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl] N-[4,5-bis[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazole-5-carbonyl]amino]-2-[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]oxymethylamino]phenyl]methanimidate;2-[5-[[3-[[2-(2-hydroxy-5-methylphenyl)benzotriazol-5-yl]oxymethylamino]anilino]methoxy]benzotriazol-2-yl]-4,6-dimethylphenol is Cc1cc(C)c(O)c(-n2nc3ccc(NC(=O)c4cc5ccccc5cc4C(=O)Nc4ccc5nn(-c6cc(C)cc(C)c6O)nc5c4)cc3n2)c1.Cc1cc(C)c(O)c(-n2nc3ccc(NC(=O)c4cscc4C(=O)Nc4ccc5nn(-c6cc(C)cc(C)c6O)nc5c4)cc3n2)c1.Cc1cc(C)c(O)c(-n2nc3ccc(O/C=N/c4cc(NC(=O)c5ccc6nn(-c7cc(C)cc(C)c7O)nc6c5)c(NC(=O)c5ccc6nn(-c7cc(C)cc(C)c7O)nc6c5)cc4NCOc4ccc5nn(-c6cc(C)cc(C)c6O)nc5c4)cc3n2)c1.Cc1cc(O)cc(-n2nc3ccc(O/C=N/c4cc5ncsc5cc4NCOc4ccc5nn(-c6cc(O)cc(C)c6O)nc5c4)cc3n2)c1O.Cc1ccc(O)c(-n2nc3ccc(OCNc4cccc(NCOc5ccc6nn(-c7cc(C)cc(C)c7O)nc6c5)c4)cc3n2)c1.
What is the InChIKey of 2-N,3-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]naphthalene-2,3-dicarboxamide;3-N,4-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]thiophene-3,4-dicarboxamide;[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl] N-[6-[[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl]oxymethylamino]-1,3-benzothiazol-5-yl]methanimidate;[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl] N-[4,5-bis[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazole-5-carbonyl]amino]-2-[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]oxymethylamino]phenyl]methanimidate;2-[5-[[3-[[2-(2-hydroxy-5-methylphenyl)benzotriazol-5-yl]oxymethylamino]anilino]methoxy]benzotriazol-2-yl]-4,6-dimethylphenol?
The InChIKey is ADICZTFZSXJGAT-WRRCHWRTSA-N. The full InChI is InChI=1S/C66H56N16O8.C40H32N8O4.C35H27N9O6S.C35H32N8O4.C34H28N8O4S/c1-33-17-37(5)61(83)57(21-33)79-71-45-13-9-41(25-53(45)75-79)65(87)69-51-29-49(67-31-89-43-11-15-47-55(27-43)77-81(73-47)59-23-35(3)19-39(7)63(59)85)50(68-32-90-44-12-16-48-56(28-44)78-82(74-48)60-24-36(4)20-40(8)64(60)86)30-52(51)70-66(88)42-10-14-46-54(26-42)76-80(72-46)58-22-34(2)18-38(6)62(58)84;1-21-13-23(3)37(49)35(15-21)47-43-31-11-9-27(19-33(31)45-47)41-39(51)29-17-25-7-5-6-8-26(25)18-30(29)40(52)42-28-10-12-32-34(20-28)46-48(44-32)36-16-22(2)14-24(4)38(36)50;1-18-7-20(45)9-31(34(18)47)43-39-24-5-3-22(11-28(24)41-43)49-15-36-26-13-30-33(51-17-38-30)14-27(26)37-16-50-23-4-6-25-29(12-23)42-44(40-25)32-10-21(46)8-19(2)35(32)48;1-21-7-12-34(44)32(14-21)42-38-28-10-8-26(17-30(28)40-42)46-19-36-24-5-4-6-25(16-24)37-20-47-27-9-11-29-31(18-27)41-43(39-29)33-15-22(2)13-23(3)35(33)45;1-17-9-19(3)31(43)29(11-17)41-37-25-7-5-21(13-27(25)39-41)35-33(45)23-15-47-16-24(23)34(46)36-22-6-8-26-28(14-22)40-42(38-26)30-12-18(2)10-20(4)32(30)44/h9-31,68,83-86H,32H2,1-8H3,(H,69,87)(H,70,88);5-20,49-50H,1-4H3,(H,41,51)(H,42,52);3-15,17,37,45-48H,16H2,1-2H3;4-18,36-37,44-45H,19-20H2,1-3H3;5-16,43-44H,1-4H3,(H,35,45)(H,36,46)/b67-31+;;36-15+;;.
What are the key properties of 2-N,3-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]naphthalene-2,3-dicarboxamide;3-N,4-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]thiophene-3,4-dicarboxamide;[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl] N-[6-[[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl]oxymethylamino]-1,3-benzothiazol-5-yl]methanimidate;[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl] N-[4,5-bis[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazole-5-carbonyl]amino]-2-[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]oxymethylamino]phenyl]methanimidate;2-[5-[[3-[[2-(2-hydroxy-5-methylphenyl)benzotriazol-5-yl]oxymethylamino]anilino]methoxy]benzotriazol-2-yl]-4,6-dimethylphenol?
2-N,3-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]naphthalene-2,3-dicarboxamide;3-N,4-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]thiophene-3,4-dicarboxamide;[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl] N-[6-[[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl]oxymethylamino]-1,3-benzothiazol-5-yl]methanimidate;[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl] N-[4,5-bis[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazole-5-carbonyl]amino]-2-[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]oxymethylamino]phenyl]methanimidate;2-[5-[[3-[[2-(2-hydroxy-5-methylphenyl)benzotriazol-5-yl]oxymethylamino]anilino]methoxy]benzotriazol-2-yl]-4,6-dimethylphenol has a molecular weight of 3865.16 g/mol, XLogP of 38.20, 46 rotatable bonds, 24 hydrogen bond donors, and 71 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,3-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]naphthalene-2,3-dicarboxamide;3-N,4-N-bis[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]thiophene-3,4-dicarboxamide;[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl] N-[6-[[2-(2,5-dihydroxy-3-methylphenyl)benzotriazol-5-yl]oxymethylamino]-1,3-benzothiazol-5-yl]methanimidate;[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl] N-[4,5-bis[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazole-5-carbonyl]amino]-2-[[2-(2-hydroxy-3,5-dimethylphenyl)benzotriazol-5-yl]oxymethylamino]phenyl]methanimidate;2-[5-[[3-[[2-(2-hydroxy-5-methylphenyl)benzotriazol-5-yl]oxymethylamino]anilino]methoxy]benzotriazol-2-yl]-4,6-dimethylphenol is sourced from PubChem (CID 157079169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).