N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline

C168H106N4O3S2 — CID 175622996

IUPACN-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc6c7ccc(-c8cc(-c9ccc(N(c%10ccc(-c%11ccccc%11)cc%10)c%10ccc(-c%11ccccc%11)cc%10)cc9)cc9c8sc8ccccc89)cc7n(-c7ccccc7)c6c5)cc4)cc3)c3ccc(-c4cc(-c5ccc(-c6ccc(-c7ccc(N(c8ccc(-c9ccccc9)cc8)c8ccc(-c9cc(-c%10cccc%11c%10sc%10ccccc%10%11)c%10oc%11ccccc%11c%10c9)cc8)cc7)cc6)c6c5oc5ccccc56)c5oc6ccccc6c5c4)cc3)cc2)cc1
InChIInChI=1S/C168H106N4O3S2/c1-6-27-107(28-7-1)113-57-77-130(78-58-113)169(131-79-59-114(60-80-131)108-29-8-2-9-30-108)136-89-69-120(70-90-136)126-99-150(168-155(104-126)145-40-20-25-48-162(145)177-168)125-76-96-141-140-95-75-124(105-156(140)172(157(141)106-125)129-35-14-5-15-36-129)119-51-49-111(50-52-119)117-65-85-134(86-66-117)170(132-81-61-115(62-82-132)109-31-10-3-11-32-109)137-91-71-121(72-92-137)127-100-151-142-37-16-21-44-158(142)173-164(151)153(102-127)146-98-97-139(163-149-41-18-23-46-160(149)175-166(146)163)123-55-53-112(54-56-123)118-67-87-135(88-68-118)171(133-83-63-116(64-84-133)110-33-12-4-13-34-110)138-93-73-122(74-94-138)128-101-152-143-38-17-22-45-159(143)174-165(152)154(103-128)148-43-26-42-147-144-39-19-24-47-161(144)176-167(147)148/h1-106H
InChIKeyJULICEXGHGQIDL-UHFFFAOYSA-N
MW2292.85 g/mol
LogP48.97
Rot. Bonds24

About N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline

N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline (PubChem CID 175622996) has the molecular formula C168H106N4O3S2 and a molecular weight of 2292.85 g/mol. Its IUPAC name is N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline.

Molecular Properties

Compound NameN-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
PubChem CID175622996
Molecular FormulaC168H106N4O3S2
Molecular Weight2292.85 g/mol
Exact Mass2290.77
IUPAC NameN-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc6c7ccc(-c8cc(-c9ccc(N(c%10ccc(-c%11ccccc%11)cc%10)c%10ccc(-c%11ccccc%11)cc%10)cc9)cc9c8sc8ccccc89)cc7n(-c7ccccc7)c6c5)cc4)cc3)c3ccc(-c4cc(-c5ccc(-c6ccc(-c7ccc(N(c8ccc(-c9ccccc9)cc8)c8ccc(-c9cc(-c%10cccc%11c%10sc%10ccccc%10%11)c%10oc%11ccccc%11c%10c9)cc8)cc7)cc6)c6c5oc5ccccc56)c5oc6ccccc6c5c4)cc3)cc2)cc1
InChIInChI=1S/C168H106N4O3S2/c1-6-27-107(28-7-1)113-57-77-130(78-58-113)169(131-79-59-114(60-80-131)108-29-8-2-9-30-108)136-89-69-120(70-90-136)126-99-150(168-155(104-126)145-40-20-25-48-162(145)177-168)125-76-96-141-140-95-75-124(105-156(140)172(157(141)106-125)129-35-14-5-15-36-129)119-51-49-111(50-52-119)117-65-85-134(86-66-117)170(132-81-61-115(62-82-132)109-31-10-3-11-32-109)137-91-71-121(72-92-137)127-100-151-142-37-16-21-44-158(142)173-164(151)153(102-127)146-98-97-139(163-149-41-18-23-46-160(149)175-166(146)163)123-55-53-112(54-56-123)118-67-87-135(88-68-118)171(133-83-63-116(64-84-133)110-33-12-4-13-34-110)138-93-73-122(74-94-138)128-101-152-143-38-17-22-45-159(143)174-165(152)154(103-128)148-43-26-42-147-144-39-19-24-47-161(144)176-167(147)148/h1-106H
InChIKeyJULICEXGHGQIDL-UHFFFAOYSA-N
XLogP48.97
TPSA54.07 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds24
Heavy Atoms177
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002292.85
LogP ≤ 548.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline?
The IUPAC name of N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline (CID 175622996) is N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline.
What is the SMILES notation for N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline?
The canonical SMILES for N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline is c1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc6c7ccc(-c8cc(-c9ccc(N(c%10ccc(-c%11ccccc%11)cc%10)c%10ccc(-c%11ccccc%11)cc%10)cc9)cc9c8sc8ccccc89)cc7n(-c7ccccc7)c6c5)cc4)cc3)c3ccc(-c4cc(-c5ccc(-c6ccc(-c7ccc(N(c8ccc(-c9ccccc9)cc8)c8ccc(-c9cc(-c%10cccc%11c%10sc%10ccccc%10%11)c%10oc%11ccccc%11c%10c9)cc8)cc7)cc6)c6c5oc5ccccc56)c5oc6ccccc6c5c4)cc3)cc2)cc1.
What is the InChIKey of N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline?
The InChIKey is JULICEXGHGQIDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C168H106N4O3S2/c1-6-27-107(28-7-1)113-57-77-130(78-58-113)169(131-79-59-114(60-80-131)108-29-8-2-9-30-108)136-89-69-120(70-90-136)126-99-150(168-155(104-126)145-40-20-25-48-162(145)177-168)125-76-96-141-140-95-75-124(105-156(140)172(157(141)106-125)129-35-14-5-15-36-129)119-51-49-111(50-52-119)117-65-85-134(86-66-117)170(132-81-61-115(62-82-132)109-31-10-3-11-32-109)137-91-71-121(72-92-137)127-100-151-142-37-16-21-44-158(142)173-164(151)153(102-127)146-98-97-139(163-149-41-18-23-46-160(149)175-166(146)163)123-55-53-112(54-56-123)118-67-87-135(88-68-118)171(133-83-63-116(64-84-133)110-33-12-4-13-34-110)138-93-73-122(74-94-138)128-101-152-143-38-17-22-45-159(143)174-165(152)154(103-128)148-43-26-42-147-144-39-19-24-47-161(144)176-167(147)148/h1-106H.
What are the key properties of N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline?
N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline has a molecular weight of 2292.85 g/mol, XLogP of 48.97, 24 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-[7-[4-[4-(N-[4-[4-[1-[4-[4-(N-[4-(4-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-4-phenylanilino)phenyl]phenyl]dibenzofuran-4-yl]dibenzofuran-2-yl]phenyl]-4-phenylanilino)phenyl]phenyl]-9-phenylcarbazol-2-yl]dibenzothiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 175622996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).