5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine

C272H188N30O2S4 — CID 157196602

IUPAC5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine
SMILESc1ccc(-c2ccc(-n3nc4ccc(N(c5ccccc5)c5ccc(-c6ccc(-c7ccc(N(c8ccccc8)c8ccc9nn(-c%10ccc(-c%11ccccc%11)cc%10)nc9c8)cc7)cc6)cc5)cc4n3)cc2)cc1.c1ccc(-c2ccc3nc(C(c4ccccc4)c4ccc(-c5ccc(N(c6ccccc6)c6nc7ccc(-c8ccccc8)cc7s6)cc5)cc4)sc3c2)cc1.c1ccc(-c2ccc3oc(C(c4ccccc4)c4ccc(-c5ccc(N(c6ccccc6)c6nc7cc(-c8ccccc8)ccc7o6)cc5)cc4)nc3c2)cc1.c1ccc(N(c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccc(-n6nc7ccccc7n6)s5)cc4)cc3)cc2)c2ccc(-n3nc4ccccc4n3)s2)cc1.c1ccc(N(c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccc6nn(-c7ccccc7)nc6c5)cc4)cc3)cc2)c2ccc3nn(-c4ccccc4)nc3c2)cc1
InChIInChI=1S/C66H46N8.C54H38N8.C51H35N3O2.C51H35N3S2.C50H34N8S2/c1-5-13-47(14-6-1)51-29-37-59(38-30-51)73-67-63-43-41-61(45-65(63)69-73)71(55-17-9-3-10-18-55)57-33-25-53(26-34-57)49-21-23-50(24-22-49)54-27-35-58(36-28-54)72(56-19-11-4-12-20-56)62-42-44-64-66(46-62)70-74(68-64)60-39-31-52(32-40-60)48-15-7-2-8-16-48;1-5-13-43(14-6-1)59(49-33-35-51-53(37-49)57-61(55-51)47-17-9-3-10-18-47)45-29-25-41(26-30-45)39-21-23-40(24-22-39)42-27-31-46(32-28-42)60(44-15-7-2-8-16-44)50-34-36-52-54(38-50)58-62(56-52)48-19-11-4-12-20-48;1-5-13-35(14-6-1)41-27-31-47-45(33-41)52-50(55-47)49(39-17-9-3-10-18-39)40-23-21-37(22-24-40)38-25-29-44(30-26-38)54(43-19-11-4-12-20-43)51-53-46-34-42(28-32-48(46)56-51)36-15-7-2-8-16-36;1-5-13-35(14-6-1)41-27-31-45-47(33-41)55-50(52-45)49(39-17-9-3-10-18-39)40-23-21-37(22-24-40)38-25-29-44(30-26-38)54(43-19-11-4-12-20-43)51-53-46-32-28-42(34-48(46)56-51)36-15-7-2-8-16-36;1-3-11-39(12-4-1)55(47-31-33-49(59-47)57-51-43-15-7-8-16-44(43)52-57)41-27-23-37(24-28-41)35-19-21-36(22-20-35)38-25-29-42(30-26-38)56(40-13-5-2-6-14-40)48-32-34-50(60-48)58-53-45-17-9-10-18-46(45)54-58/h1-46H;1-38H;2*1-34,49H;1-34H
InChIKeyAQHZERJZRJOCBM-UHFFFAOYSA-N
MW4036.97 g/mol
LogP71.92
Rot. Bonds50

About 5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine

5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine (PubChem CID 157196602) has the molecular formula C272H188N30O2S4 and a molecular weight of 4036.97 g/mol. Its IUPAC name is 5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine.

Molecular Properties

Compound Name5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine
PubChem CID157196602
Molecular FormulaC272H188N30O2S4
Molecular Weight4036.97 g/mol
Exact Mass4033.44
IUPAC Name5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine
SMILESc1ccc(-c2ccc(-n3nc4ccc(N(c5ccccc5)c5ccc(-c6ccc(-c7ccc(N(c8ccccc8)c8ccc9nn(-c%10ccc(-c%11ccccc%11)cc%10)nc9c8)cc7)cc6)cc5)cc4n3)cc2)cc1.c1ccc(-c2ccc3nc(C(c4ccccc4)c4ccc(-c5ccc(N(c6ccccc6)c6nc7ccc(-c8ccccc8)cc7s6)cc5)cc4)sc3c2)cc1.c1ccc(-c2ccc3oc(C(c4ccccc4)c4ccc(-c5ccc(N(c6ccccc6)c6nc7cc(-c8ccccc8)ccc7o6)cc5)cc4)nc3c2)cc1.c1ccc(N(c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccc(-n6nc7ccccc7n6)s5)cc4)cc3)cc2)c2ccc(-n3nc4ccccc4n3)s2)cc1.c1ccc(N(c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccc6nn(-c7ccccc7)nc6c5)cc4)cc3)cc2)c2ccc3nn(-c4ccccc4)nc3c2)cc1
InChIInChI=1S/C66H46N8.C54H38N8.C51H35N3O2.C51H35N3S2.C50H34N8S2/c1-5-13-47(14-6-1)51-29-37-59(38-30-51)73-67-63-43-41-61(45-65(63)69-73)71(55-17-9-3-10-18-55)57-33-25-53(26-34-57)49-21-23-50(24-22-49)54-27-35-58(36-28-54)72(56-19-11-4-12-20-56)62-42-44-64-66(46-62)70-74(68-64)60-39-31-52(32-40-60)48-15-7-2-8-16-48;1-5-13-43(14-6-1)59(49-33-35-51-53(37-49)57-61(55-51)47-17-9-3-10-18-47)45-29-25-41(26-30-45)39-21-23-40(24-22-39)42-27-31-46(32-28-42)60(44-15-7-2-8-16-44)50-34-36-52-54(38-50)58-62(56-52)48-19-11-4-12-20-48;1-5-13-35(14-6-1)41-27-31-47-45(33-41)52-50(55-47)49(39-17-9-3-10-18-39)40-23-21-37(22-24-40)38-25-29-44(30-26-38)54(43-19-11-4-12-20-43)51-53-46-34-42(28-32-48(46)56-51)36-15-7-2-8-16-36;1-5-13-35(14-6-1)41-27-31-45-47(33-41)55-50(52-45)49(39-17-9-3-10-18-39)40-23-21-37(22-24-40)38-25-29-44(30-26-38)54(43-19-11-4-12-20-43)51-53-46-32-28-42(34-48(46)56-51)36-15-7-2-8-16-36;1-3-11-39(12-4-1)55(47-31-33-49(59-47)57-51-43-15-7-8-16-44(43)52-57)41-27-23-37(24-28-41)35-19-21-36(22-20-35)38-25-29-42(30-26-38)56(40-13-5-2-6-14-40)48-32-34-50(60-48)58-53-45-17-9-10-18-46(45)54-58/h1-46H;1-38H;2*1-34,49H;1-34H
InChIKeyAQHZERJZRJOCBM-UHFFFAOYSA-N
XLogP71.92
TPSA288.02 Ų
H-Bond Donors
H-Bond Acceptors36
Rotatable Bonds50
Heavy Atoms308
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004036.97
LogP ≤ 571.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1036

Analyze 5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine with MolForge

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Related Compounds

2-[4-(1,3-Benzothiazol-2-yl)-2,3,5,6-tetrakis(3,6-dimethylcarbazol-9-yl)phenyl]-1,3-benzoxazole
CID 139533388
2-[4-(1,3-Benzothiazol-2-yl)-2,3,5,6-tetra(carbazol-9-yl)phenyl]-1,3-benzoxazole
CID 139533390
2-[4-[2-[4-(1,3-Benzothiazol-2-yl)phenyl]-5-[4-[2-[4-(1,3-benzothiazol-2-yl)phenyl]-3-[4-(5-tert-butyl-1,3-benzoxazol-2-yl)phenyl]-3,4-dihydropyrazol-5-yl]phenyl]-3,4-dihydropyrazol-3-yl]phenyl]-5-tert-butyl-1,3-benzoxazole
CID 140041047
2-[8-[2-([1]Benzothiolo[3,2-b]carbazol-11-yl)-1,3-benzothiazol-5-yl]-[1]benzothiolo[3,2-b]carbazol-11-yl]-5-[11-(1-methylbenzimidazol-2-yl)-[1]benzothiolo[3,2-b]carbazol-8-yl]-1,3-benzoxazole
CID 146407185
(2Z,4E)-3-[(N-[4-[4-(N-[5-[4-[2-[2-[N-cyclohexa-1,3-dien-1-yl-4-[4-(N-(6-phenyl-1,3-benzothiazol-2-yl)anilino)phenyl]anilino]-1,3-benzothiazol-6-yl]phenyl]phenyl]-1,3-benzoxazol-2-yl]anilino)phenyl]phenyl]anilino)methylamino]-5-[3-[3-[5-(N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]anilino)benzotriazol-2-yl]phenyl]phenyl]hepta-2,4,6-trien-2-ol
CID 146631307
7-[6-[3-[1-[7-[6-[3-(Benzimidazolo[1,2-a]benzimidazol-5-yl)phenyl]indolo[2,3-b]indol-5-yl]benzimidazolo[2,1-b][1,3]benzothiazol-3-yl]benzimidazolo[1,2-a]benzimidazol-6-yl]phenyl]indolo[2,3-b]indol-5-yl]benzimidazolo[2,1-b][1,3]benzoxazole
CID 146631696
N-phenyl-5-[4-[2-[2-(N-[4-[4-(N-(6-phenyl-1,3-benzothiazol-2-yl)anilino)phenyl]phenyl]anilino)-1,3-benzothiazol-6-yl]phenyl]phenyl]-N-[4-[4-(N-[5-[3-[3-[5-(N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]anilino)benzotriazol-2-yl]phenyl]phenyl]-1,3-benzoxazol-2-yl]anilino)phenyl]phenyl]-1,3-benzoxazol-2-amine
CID 146650563
N-phenyl-N-[4-[4-(N-[5-[4-[2-[2-(N-[4-[4-(N-(6-phenyl-1,3-benzothiazol-2-yl)anilino)phenyl]phenyl]anilino)-1,3-benzothiazol-6-yl]phenyl]phenyl]-1,3-benzoxazol-2-yl]anilino)cyclohexa-1,3-dien-1-yl]phenyl]-5-[4-[4-[5-(N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]anilino)benzotriazol-2-yl]cyclohexa-2,4-dien-1-yl]phenyl]-1,3-benzoxazol-2-amine
CID 146650578
N-[[4-[4-[3-(benzotriazol-2-yl)-N-dibenzothiophen-2-ylanilino]phenyl]phenyl]methyl]-N-[3-[5-[2-[4-(N-[4-[3-[4-(N-[4-(1,3-benzoxazol-2-yl)phenyl]anilino)-3-methylcyclohexa-1,5-dien-1-yl]phenyl]phenyl]anilino)phenyl]-1,3-benzoxazol-5-yl]benzotriazol-2-yl]phenyl]dibenzothiophen-2-amine
CID 146650609
2-[6-[6-[2-[6-(1,3-Benzoxazol-2-yl)-9-(3-carbazol-9-ylphenyl)carbazol-3-yl]-1,3-benzoxazol-4-yl]-1,3-benzothiazol-2-yl]-9-(1-phenylbenzimidazol-2-yl)carbazol-3-yl]-6-phenyl-5-[3-[2-[9-(1-phenylbenzimidazol-2-yl)-6-(6-phenyl-1,3-benzoxazol-2-yl)carbazol-3-yl]-1,3-benzothiazol-6-yl]phenyl]-1,3-benzoxazole
CID 155366256
N-phenyl-N-[4-[4-(N-[5-[4-[2-[2-(N-[4-[4-(N-(6-phenyl-1,3-benzothiazol-2-yl)anilino)phenyl]phenyl]anilino)-1,3-benzothiazol-6-yl]phenyl]phenyl]-1,3-benzoxazol-2-yl]anilino)phenyl]phenyl]-5-[4-[4-[5-(N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]anilino)benzotriazol-2-yl]phenyl]phenyl]-1,3-benzoxazol-2-amine
CID 156349796
2-[4-[3-[3-(2,6-Diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzothiazole;2-[4-[3-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazin-2-yl]-1,3-benzoxazole;2-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]-1,3-benzoxazole;2-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]-1,3-benzoxazole;1-[4-[4-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-6-phenylpyrimidin-2-yl]phenyl]-2-phenylbenzimidazole;1-[4-[6-[3-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-2-phenylpyrimidin-4-yl]phenyl]-2-phenylbenzimidazole
CID 157316716

Frequently Asked Questions

What is the IUPAC name of 5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine?
The IUPAC name of 5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine (CID 157196602) is 5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine.
What is the SMILES notation for 5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine?
The canonical SMILES for 5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine is c1ccc(-c2ccc(-n3nc4ccc(N(c5ccccc5)c5ccc(-c6ccc(-c7ccc(N(c8ccccc8)c8ccc9nn(-c%10ccc(-c%11ccccc%11)cc%10)nc9c8)cc7)cc6)cc5)cc4n3)cc2)cc1.c1ccc(-c2ccc3nc(C(c4ccccc4)c4ccc(-c5ccc(N(c6ccccc6)c6nc7ccc(-c8ccccc8)cc7s6)cc5)cc4)sc3c2)cc1.c1ccc(-c2ccc3oc(C(c4ccccc4)c4ccc(-c5ccc(N(c6ccccc6)c6nc7cc(-c8ccccc8)ccc7o6)cc5)cc4)nc3c2)cc1.c1ccc(N(c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccc(-n6nc7ccccc7n6)s5)cc4)cc3)cc2)c2ccc(-n3nc4ccccc4n3)s2)cc1.c1ccc(N(c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccc6nn(-c7ccccc7)nc6c5)cc4)cc3)cc2)c2ccc3nn(-c4ccccc4)nc3c2)cc1.
What is the InChIKey of 5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine?
The InChIKey is AQHZERJZRJOCBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H46N8.C54H38N8.C51H35N3O2.C51H35N3S2.C50H34N8S2/c1-5-13-47(14-6-1)51-29-37-59(38-30-51)73-67-63-43-41-61(45-65(63)69-73)71(55-17-9-3-10-18-55)57-33-25-53(26-34-57)49-21-23-50(24-22-49)54-27-35-58(36-28-54)72(56-19-11-4-12-20-56)62-42-44-64-66(46-62)70-74(68-64)60-39-31-52(32-40-60)48-15-7-2-8-16-48;1-5-13-43(14-6-1)59(49-33-35-51-53(37-49)57-61(55-51)47-17-9-3-10-18-47)45-29-25-41(26-30-45)39-21-23-40(24-22-39)42-27-31-46(32-28-42)60(44-15-7-2-8-16-44)50-34-36-52-54(38-50)58-62(56-52)48-19-11-4-12-20-48;1-5-13-35(14-6-1)41-27-31-47-45(33-41)52-50(55-47)49(39-17-9-3-10-18-39)40-23-21-37(22-24-40)38-25-29-44(30-26-38)54(43-19-11-4-12-20-43)51-53-46-34-42(28-32-48(46)56-51)36-15-7-2-8-16-36;1-5-13-35(14-6-1)41-27-31-45-47(33-41)55-50(52-45)49(39-17-9-3-10-18-39)40-23-21-37(22-24-40)38-25-29-44(30-26-38)54(43-19-11-4-12-20-43)51-53-46-32-28-42(34-48(46)56-51)36-15-7-2-8-16-36;1-3-11-39(12-4-1)55(47-31-33-49(59-47)57-51-43-15-7-8-16-44(43)52-57)41-27-23-37(24-28-41)35-19-21-36(22-20-35)38-25-29-42(30-26-38)56(40-13-5-2-6-14-40)48-32-34-50(60-48)58-53-45-17-9-10-18-46(45)54-58/h1-46H;1-38H;2*1-34,49H;1-34H.
What are the key properties of 5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine?
5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine has a molecular weight of 4036.97 g/mol, XLogP of 71.92, 50 rotatable bonds, 0 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]phenyl]-N-phenylthiophen-2-amine;N,2-diphenyl-N-[4-[4-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine;N,6-diphenyl-N-[4-[4-[phenyl-(6-phenyl-1,3-benzothiazol-2-yl)methyl]phenyl]phenyl]-1,3-benzothiazol-2-amine;N,5-diphenyl-N-[4-[4-[phenyl-(5-phenyl-1,3-benzoxazol-2-yl)methyl]phenyl]phenyl]-1,3-benzoxazol-2-amine;N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine is sourced from PubChem (CID 157196602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).