N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine

C156H106N20S2 — CID 163609357

IUPACN-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine
SMILESc1ccc(N(c2ccc(-c3ccc(-c4ccc(N(c5ccc(-n6ccc7ccccc76)cc5)c5cccc(-c6ccc(N(c7ccc(-c8ccc(N(c9ccccc9)c9ccc%10nn(-c%11ccccc%11)nc%10c9)cc8)cc7)c7ccc8nn(-c9cccc(-c%10ccc(N(c%11ccc(-c%12ccc(-c%13ccc(N(c%14ccccc%14)c%14ccc(-n%15nc%16ccccc%16n%15)s%14)cc%13)cc%12)cc%11)c%11ccc(-n%12nc%13ccccc%13n%12)s%11)cc%10)c9)nc8c7)cc6)c5)cc4)cc3)cc2)c2ccc(-n3ccc4ccccc43)cc2)cc1
InChIInChI=1S/C156H106N20S2/c1-5-27-125(28-6-1)167(133-87-83-123(84-88-133)165-101-99-119-23-13-19-41-151(119)165)128-67-51-111(52-68-128)107-43-45-108(46-44-107)112-53-71-130(72-54-112)169(134-89-85-124(86-90-134)166-102-100-120-24-14-20-42-152(120)166)139-35-21-25-121(103-139)117-63-75-132(76-64-117)170(131-73-57-116(58-74-131)115-55-69-129(70-56-115)168(126-29-7-2-8-30-126)140-91-93-147-149(105-140)163-173(157-147)138-33-11-4-12-34-138)141-92-94-148-150(106-141)164-174(158-148)142-36-22-26-122(104-142)118-65-81-137(82-66-118)172(154-96-98-156(178-154)176-161-145-39-17-18-40-146(145)162-176)136-79-61-114(62-80-136)110-49-47-109(48-50-110)113-59-77-135(78-60-113)171(127-31-9-3-10-32-127)153-95-97-155(177-153)175-159-143-37-15-16-38-144(143)160-175/h1-106H
InChIKeyHEOJIPGHDTVZHP-UHFFFAOYSA-N
MW2324.84 g/mol
LogP41.12
Rot. Bonds31

About N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine

N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine (PubChem CID 163609357) has the molecular formula C156H106N20S2 and a molecular weight of 2324.84 g/mol. Its IUPAC name is N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine.

Molecular Properties

Compound NameN-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine
PubChem CID163609357
Molecular FormulaC156H106N20S2
Molecular Weight2324.84 g/mol
Exact Mass2322.84
IUPAC NameN-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine
SMILESc1ccc(N(c2ccc(-c3ccc(-c4ccc(N(c5ccc(-n6ccc7ccccc76)cc5)c5cccc(-c6ccc(N(c7ccc(-c8ccc(N(c9ccccc9)c9ccc%10nn(-c%11ccccc%11)nc%10c9)cc8)cc7)c7ccc8nn(-c9cccc(-c%10ccc(N(c%11ccc(-c%12ccc(-c%13ccc(N(c%14ccccc%14)c%14ccc(-n%15nc%16ccccc%16n%15)s%14)cc%13)cc%12)cc%11)c%11ccc(-n%12nc%13ccccc%13n%12)s%11)cc%10)c9)nc8c7)cc6)c5)cc4)cc3)cc2)c2ccc(-n3ccc4ccccc43)cc2)cc1
InChIInChI=1S/C156H106N20S2/c1-5-27-125(28-6-1)167(133-87-83-123(84-88-133)165-101-99-119-23-13-19-41-151(119)165)128-67-51-111(52-68-128)107-43-45-108(46-44-107)112-53-71-130(72-54-112)169(134-89-85-124(86-90-134)166-102-100-120-24-14-20-42-152(120)166)139-35-21-25-121(103-139)117-63-75-132(76-64-117)170(131-73-57-116(58-74-131)115-55-69-129(70-56-115)168(126-29-7-2-8-30-126)140-91-93-147-149(105-140)163-173(157-147)138-33-11-4-12-34-138)141-92-94-148-150(106-141)164-174(158-148)142-36-22-26-122(104-142)118-65-81-137(82-66-118)172(154-96-98-156(178-154)176-161-145-39-17-18-40-146(145)162-176)136-79-61-114(62-80-136)110-49-47-109(48-50-110)113-59-77-135(78-60-113)171(127-31-9-3-10-32-127)153-95-97-155(177-153)175-159-143-37-15-16-38-144(143)160-175/h1-106H
InChIKeyHEOJIPGHDTVZHP-UHFFFAOYSA-N
XLogP41.12
TPSA152.14 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds31
Heavy Atoms178
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002324.84
LogP ≤ 541.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine with MolForge

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Related Compounds

N,2-diphenyl-N-[4-[3-[4-(N-(2-phenylbenzotriazol-5-yl)anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine
CID 144768909
N-phenyl-2-(4-phenylphenyl)-N-[4-[4-[4-(N-[2-(4-phenylphenyl)benzotriazol-5-yl]anilino)phenyl]phenyl]phenyl]benzotriazol-5-amine
CID 144768912
N-phenyl-N-(4-phenylphenyl)-2-[4-(N-(4-phenylphenyl)anilino)phenyl]benzotriazol-5-amine
CID 153395124
3-(benzotriazol-2-yl)-N-[4-[4-[4-(N-[3-(benzotriazol-2-yl)phenyl]anilino)phenyl]phenyl]phenyl]-N-phenylaniline
CID 149332303
N-[4-(benzotriazol-2-yl)phenyl]-2-[4-(N-[4-(benzotriazol-2-yl)phenyl]anilino)phenyl]-N-phenylbenzotriazol-5-amine
CID 161309398
2-[4-[4-(4-tert-butylphenyl)phenyl]phenyl]-N,N-diphenylbenzotriazol-5-amine
CID 59653212
N-(4-naphthalen-2-ylphenyl)-4-phenyl-N-[4-(1-phenylindol-5-yl)phenyl]aniline
CID 71100769
5-(1-phenylindol-5-yl)-1-N,1-N,3-N,3-N-tetrakis(4-phenylphenyl)benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetranaphthalen-1-yl-5-(1-phenylindol-5-yl)benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[1-(4-phenylphenyl)indol-5-yl]benzene-1,3-diamine
CID 159943558
4-(4-indol-1-yl-2-methylphenyl)-3-methyl-N-phenyl-N-(4-phenylphenyl)aniline
CID 90215964
4-(1,3-benzoxazol-2-yl)-N-[4-(1,3-benzoxazol-2-yl)phenyl]-N-(4-indol-1-ylphenyl)aniline
CID 166922197
N,2-diphenyl-N-(2-phenylbenzotriazol-5-yl)naphtho[2,1-g][1,3]benzoxazol-10-amine
CID 164740317
N-[3-(benzotriazol-2-yl)phenyl]-N-[4-(benzotriazol-2-yl)phenyl]triphenylen-2-amine
CID 155317863

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine?
The IUPAC name of N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine (CID 163609357) is N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine.
What is the SMILES notation for N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine?
The canonical SMILES for N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine is c1ccc(N(c2ccc(-c3ccc(-c4ccc(N(c5ccc(-n6ccc7ccccc76)cc5)c5cccc(-c6ccc(N(c7ccc(-c8ccc(N(c9ccccc9)c9ccc%10nn(-c%11ccccc%11)nc%10c9)cc8)cc7)c7ccc8nn(-c9cccc(-c%10ccc(N(c%11ccc(-c%12ccc(-c%13ccc(N(c%14ccccc%14)c%14ccc(-n%15nc%16ccccc%16n%15)s%14)cc%13)cc%12)cc%11)c%11ccc(-n%12nc%13ccccc%13n%12)s%11)cc%10)c9)nc8c7)cc6)c5)cc4)cc3)cc2)c2ccc(-n3ccc4ccccc43)cc2)cc1.
What is the InChIKey of N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine?
The InChIKey is HEOJIPGHDTVZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C156H106N20S2/c1-5-27-125(28-6-1)167(133-87-83-123(84-88-133)165-101-99-119-23-13-19-41-151(119)165)128-67-51-111(52-68-128)107-43-45-108(46-44-107)112-53-71-130(72-54-112)169(134-89-85-124(86-90-134)166-102-100-120-24-14-20-42-152(120)166)139-35-21-25-121(103-139)117-63-75-132(76-64-117)170(131-73-57-116(58-74-131)115-55-69-129(70-56-115)168(126-29-7-2-8-30-126)140-91-93-147-149(105-140)163-173(157-147)138-33-11-4-12-34-138)141-92-94-148-150(106-141)164-174(158-148)142-36-22-26-122(104-142)118-65-81-137(82-66-118)172(154-96-98-156(178-154)176-161-145-39-17-18-40-146(145)162-176)136-79-61-114(62-80-136)110-49-47-109(48-50-110)113-59-77-135(78-60-113)171(127-31-9-3-10-32-127)153-95-97-155(177-153)175-159-143-37-15-16-38-144(143)160-175/h1-106H.
What are the key properties of N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine?
N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine has a molecular weight of 2324.84 g/mol, XLogP of 41.12, 31 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-[N-[2-[3-[4-[N-[5-(benzotriazol-2-yl)thiophen-2-yl]-4-[4-[4-(N-[5-(benzotriazol-2-yl)thiophen-2-yl]anilino)phenyl]phenyl]anilino]phenyl]phenyl]benzotriazol-5-yl]-4-[3-[N-(4-indol-1-ylphenyl)-4-[4-[4-(N-(4-indol-1-ylphenyl)anilino)phenyl]phenyl]anilino]phenyl]anilino]phenyl]phenyl]-N,2-diphenylbenzotriazol-5-amine is sourced from PubChem (CID 163609357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).