4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate

C348H354F12N24O42 — CID 158797032

About 4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate

4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate (PubChem CID 158797032) has the molecular formula C348H354F12N24O42 and a molecular weight of 5772.76 g/mol. Its IUPAC name is 4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate.

Molecular Properties

• Compound Name: 4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate
• PubChem CID: 158797032
• Molecular Formula: C348H354F12N24O42
• Molecular Weight: 5772.76 g/mol
• Exact Mass: 5768.61
• IUPAC Name: 4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate
• SMILES: CC(C)CCOC(=O)c1ccc(OCC(COc2ccc(C(=O)OCCC(C)C)cc2)(COc2ccc(C(=O)OCCC(C)C)cc2)Cn2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4n[n+](CC(COc5ccc(C(=O)OCCC(C)C)cc5)(COc5ccc(C(=O)OCCC(C)C)cc5)COc5ccc(C(=O)OCCC(C)C)cc5)[n-]c4c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3n2)cc1.CCCCCCOC(=O)c1ccc(OCC(COc2ccc(C(=O)OCCCCCC)cc2)(COc2ccc(C(=O)OCCCCCC)cc2)Cn2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4n[n+](CC(COc5ccc(C(=O)OCCCCCC)cc5)(COc5ccc(C(=O)OCCCCCC)cc5)COc5ccc(C(=O)OCCCCCC)cc5)[n-]c4c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3n2)cc1.Cc1cc(OCC(COc2ccc(F)c(C)c2)(COc2ccc(F)c(C(F)(F)F)c2)Cn2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4n[n+](CC(COc5ccc(F)c(C)c5)(COc5ccc(F)c(C)c5)COc5ccc(F)c(C(F)(F)F)c5)[n-]c4c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3n2)ccc1F
• InChI: InChI=1S/C130H146N8O18.C124H134N8O18.C94H74F12N8O6/c1-7-13-19-37-83-145-123(139)99-55-71-111(72-56-99)151-91-129(92-152-112-73-57-100(58-74-112)124(140)146-84-38-20-14-8-2,93-153-113-75-59-101(60-76-113)125(141)147-85-39-21-15-9-3)89-135-131-119-117(97-51-67-109(68-52-97)137(105-43-29-25-30-44-105)106-45-31-26-32-46-106)121-122(118(120(119)132-135)98-53-69-110(70-54-98)138(107-47-33-27-34-48-107)108-49-35-28-36-50-108)134-136(133-121)90-130(94-154-114-77-61-102(62-78-114)126(142)148-86-40-22-16-10-4,95-155-115-79-63-103(64-80-115)127(143)149-87-41-23-17-11-5)96-156-116-81-65-104(66-82-116)128(144)150-88-42-24-18-12-6;1-85(2)65-71-139-117(133)93-37-53-105(54-38-93)145-79-123(80-146-106-55-39-94(40-56-106)118(134)140-72-66-86(3)4,81-147-107-57-41-95(42-58-107)119(135)141-73-67-87(5)6)77-129-125-113-111(91-33-49-103(50-34-91)131(99-25-17-13-18-26-99)100-27-19-14-20-28-100)115-116(112(114(113)126-129)92-35-51-104(52-36-92)132(101-29-21-15-22-30-101)102-31-23-16-24-32-102)128-130(127-115)78-124(82-148-108-59-43-96(44-60-108)120(136)142-74-68-88(7)8,83-149-109-61-45-97(46-62-109)121(137)143-75-69-89(9)10)84-150-110-63-47-98(48-64-110)122(138)144-76-70-90(11)12;1-59-45-71(33-39-79(59)95)115-53-91(54-116-72-34-40-80(96)60(2)46-72,57-119-75-37-43-83(99)77(49-75)93(101,102)103)51-111-107-87-85(63-25-29-69(30-26-63)113(65-17-9-5-10-18-65)66-19-11-6-12-20-66)89-90(86(88(87)108-111)64-27-31-70(32-28-64)114(67-21-13-7-14-22-67)68-23-15-8-16-24-68)110-112(109-89)52-92(55-117-73-35-41-81(97)61(3)47-73,56-118-74-36-42-82(98)62(4)48-74)58-120-76-38-44-84(100)78(50-76)94(104,105)106/h25-36,43-82H,7-24,37-42,83-96H2,1-6H3;13-64,85-90H,65-84H2,1-12H3;5-50H,51-58H2,1-4H3
• InChIKey: ISZJRCSKTPUKHE-UHFFFAOYSA-N
• XLogP: 78.58
• TPSA: 685.92 Ų
• H-Bond Acceptors: 60
• Rotatable Bonds: 150
• Heavy Atoms: 426
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5772.76
LogP ≤ 5	78.58
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	60

Frequently Asked Questions

What is the IUPAC name of 4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate?

The IUPAC name of 4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate (CID 158797032) is 4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate.

What is the SMILES notation for 4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate?

The canonical SMILES for 4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate is CC(C)CCOC(=O)c1ccc(OCC(COc2ccc(C(=O)OCCC(C)C)cc2)(COc2ccc(C(=O)OCCC(C)C)cc2)Cn2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4n[n+](CC(COc5ccc(C(=O)OCCC(C)C)cc5)(COc5ccc(C(=O)OCCC(C)C)cc5)COc5ccc(C(=O)OCCC(C)C)cc5)[n-]c4c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3n2)cc1.CCCCCCOC(=O)c1ccc(OCC(COc2ccc(C(=O)OCCCCCC)cc2)(COc2ccc(C(=O)OCCCCCC)cc2)Cn2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4n[n+](CC(COc5ccc(C(=O)OCCCCCC)cc5)(COc5ccc(C(=O)OCCCCCC)cc5)COc5ccc(C(=O)OCCCCCC)cc5)[n-]c4c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3n2)cc1.Cc1cc(OCC(COc2ccc(F)c(C)c2)(COc2ccc(F)c(C(F)(F)F)c2)Cn2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4n[n+](CC(COc5ccc(F)c(C)c5)(COc5ccc(F)c(C)c5)COc5ccc(F)c(C(F)(F)F)c5)[n-]c4c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3n2)ccc1F.

What is the InChIKey of 4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate?

The InChIKey is ISZJRCSKTPUKHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C130H146N8O18.C124H134N8O18.C94H74F12N8O6/c1-7-13-19-37-83-145-123(139)99-55-71-111(72-56-99)151-91-129(92-152-112-73-57-100(58-74-112)124(140)146-84-38-20-14-8-2,93-153-113-75-59-101(60-76-113)125(141)147-85-39-21-15-9-3)89-135-131-119-117(97-51-67-109(68-52-97)137(105-43-29-25-30-44-105)106-45-31-26-32-46-106)121-122(118(120(119)132-135)98-53-69-110(70-54-98)138(107-47-33-27-34-48-107)108-49-35-28-36-50-108)134-136(133-121)90-130(94-154-114-77-61-102(62-78-114)126(142)148-86-40-22-16-10-4,95-155-115-79-63-103(64-80-115)127(143)149-87-41-23-17-11-5)96-156-116-81-65-104(66-82-116)128(144)150-88-42-24-18-12-6;1-85(2)65-71-139-117(133)93-37-53-105(54-38-93)145-79-123(80-146-106-55-39-94(40-56-106)118(134)140-72-66-86(3)4,81-147-107-57-41-95(42-58-107)119(135)141-73-67-87(5)6)77-129-125-113-111(91-33-49-103(50-34-91)131(99-25-17-13-18-26-99)100-27-19-14-20-28-100)115-116(112(114(113)126-129)92-35-51-104(52-36-92)132(101-29-21-15-22-30-101)102-31-23-16-24-32-102)128-130(127-115)78-124(82-148-108-59-43-96(44-60-108)120(136)142-74-68-88(7)8,83-149-109-61-45-97(46-62-109)121(137)143-75-69-89(9)10)84-150-110-63-47-98(48-64-110)122(138)144-76-70-90(11)12;1-59-45-71(33-39-79(59)95)115-53-91(54-116-72-34-40-80(96)60(2)46-72,57-119-75-37-43-83(99)77(49-75)93(101,102)103)51-111-107-87-85(63-25-29-69(30-26-63)113(65-17-9-5-10-18-65)66-19-11-6-12-20-66)89-90(86(88(87)108-111)64-27-31-70(32-28-64)114(67-21-13-7-14-22-67)68-23-15-8-16-24-68)110-112(109-89)52-92(55-117-73-35-41-81(97)61(3)47-73,56-118-74-36-42-82(98)62(4)48-74)58-120-76-38-44-84(100)78(50-76)94(104,105)106/h25-36,43-82H,7-24,37-42,83-96H2,1-6H3;13-64,85-90H,65-84H2,1-12H3;5-50H,51-58H2,1-4H3.

What are the key properties of 4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate?

4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate has a molecular weight of 5772.76 g/mol, XLogP of 78.58, 150 rotatable bonds, 0 hydrogen bond donors, and 60 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[2,6-bis[2,2-bis[(4-fluoro-3-methylphenoxy)methyl]-3-[4-fluoro-3-(trifluoromethyl)phenoxy]propyl]-8-[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-4-yl]-N,N-diphenylaniline;hexyl 4-[3-(4-hexoxycarbonylphenoxy)-2-[[2-[3-(4-hexoxycarbonylphenoxy)-2,2-bis[(4-hexoxycarbonylphenoxy)methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[(4-hexoxycarbonylphenoxy)methyl]propoxy]benzoate;3-methylbutyl 4-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2-[[2-[3-[4-(3-methylbutoxycarbonyl)phenoxy]-2,2-bis[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propyl]-4,8-bis[4-(N-phenylanilino)phenyl]triazolo[4,5-f]benzotriazol-2-ium-3-id-6-yl]methyl]-2-[[4-(3-methylbutoxycarbonyl)phenoxy]methyl]propoxy]benzoate is sourced from PubChem (CID 158797032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).