9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine

C183H122N16 — CID 163677744

IUPAC9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine
SMILESCC12C=CC(N(c3ccccc3)c3ccccc3)=CC1c1cc(N(c3ccccc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(c4)c4cc(-n6c7ccccc7c7ccccc76)ccc4n5-c4cnc(-n5c6ccc(-n7c8ccccc8c8ccccc87)cc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)cc4-c4cccc(-c5cccc(-c6ccccc6)n5)c4)cc3)ccc1N2c1cc(-c2cccc(-c3ccncc3)c2)c(-n2c3ccc(N(c4ccccc4)c4ccccc4)cc3c3cc(N(c4ccccc4)c4ccccc4)ccc32)cn1
InChIInChI=1S/C183H122N16/c1-183-102-99-143(190(132-57-20-7-21-58-132)133-59-22-8-23-60-133)115-161(183)160-114-138(90-98-178(160)199(183)182-117-152(125-46-40-45-123(105-125)121-100-103-184-104-101-121)180(119-186-182)197-172-92-84-136(188(128-49-12-3-13-50-128)129-51-14-4-15-52-129)108-154(172)155-109-137(85-93-173(155)197)189(130-53-16-5-17-54-130)131-55-18-6-19-56-131)191(134-61-24-9-25-62-134)135-82-79-120(80-83-135)124-81-91-171-153(107-124)150-69-32-39-78-170(150)195(171)142-87-95-175-157(111-142)156-110-139(192-164-72-33-26-63-144(164)145-64-27-34-73-165(145)192)86-94-174(156)196(175)179-118-185-181(116-151(179)126-47-41-48-127(106-126)163-71-42-70-162(187-163)122-43-10-2-11-44-122)198-176-96-88-140(193-166-74-35-28-65-146(166)147-66-29-36-75-167(147)193)112-158(176)159-113-141(89-97-177(159)198)194-168-76-37-30-67-148(168)149-68-31-38-77-169(149)194/h2-119,161H,1H3
InChIKeyJIEAWPUTEXUVOL-UHFFFAOYSA-N
MW2545.10 g/mol
LogP47.64
Rot. Bonds26

About 9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine

9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine (PubChem CID 163677744) has the molecular formula C183H122N16 and a molecular weight of 2545.10 g/mol. Its IUPAC name is 9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine.

Molecular Properties

Compound Name9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine
PubChem CID163677744
Molecular FormulaC183H122N16
Molecular Weight2545.10 g/mol
Exact Mass2543.00
IUPAC Name9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine
SMILESCC12C=CC(N(c3ccccc3)c3ccccc3)=CC1c1cc(N(c3ccccc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(c4)c4cc(-n6c7ccccc7c7ccccc76)ccc4n5-c4cnc(-n5c6ccc(-n7c8ccccc8c8ccccc87)cc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)cc4-c4cccc(-c5cccc(-c6ccccc6)n5)c4)cc3)ccc1N2c1cc(-c2cccc(-c3ccncc3)c2)c(-n2c3ccc(N(c4ccccc4)c4ccccc4)cc3c3cc(N(c4ccccc4)c4ccccc4)ccc32)cn1
InChIInChI=1S/C183H122N16/c1-183-102-99-143(190(132-57-20-7-21-58-132)133-59-22-8-23-60-133)115-161(183)160-114-138(90-98-178(160)199(183)182-117-152(125-46-40-45-123(105-125)121-100-103-184-104-101-121)180(119-186-182)197-172-92-84-136(188(128-49-12-3-13-50-128)129-51-14-4-15-52-129)108-154(172)155-109-137(85-93-173(155)197)189(130-53-16-5-17-54-130)131-55-18-6-19-56-131)191(134-61-24-9-25-62-134)135-82-79-120(80-83-135)124-81-91-171-153(107-124)150-69-32-39-78-170(150)195(171)142-87-95-175-157(111-142)156-110-139(192-164-72-33-26-63-144(164)145-64-27-34-73-165(145)192)86-94-174(156)196(175)179-118-185-181(116-151(179)126-47-41-48-127(106-126)163-71-42-70-162(187-163)122-43-10-2-11-44-122)198-176-96-88-140(193-166-74-35-28-65-146(166)147-66-29-36-75-167(147)193)112-158(176)159-113-141(89-97-177(159)198)194-168-76-37-30-67-148(168)149-68-31-38-77-169(149)194/h2-119,161H,1H3
InChIKeyJIEAWPUTEXUVOL-UHFFFAOYSA-N
XLogP47.64
TPSA102.27 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds26
Heavy Atoms199
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002545.10
LogP ≤ 547.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine with MolForge

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Related Compounds

3,6-di(carbazol-9-yl)-9-[5-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(2,6-diphenylpyrimidin-4-yl)phenyl]-2-pyridinyl]carbazole
CID 175978291
1-N-(9a-methyl-9-phenyl-4aH-carbazol-3-yl)-1-N,4-N-di(anthracen-2-yl)-4-N-(9-phenylcarbazol-3-yl)benzene-1,4-diamine
CID 163422933
9-[4-[3-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-N,N-diphenylcarbazol-3-amine
CID 135252863
N,N-diphenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]-9-[4-(4-phenylpyrimidin-2-yl)phenyl]carbazol-3-amine
CID 90182899
3-[2,5-bis[3-(6-phenyl-2-pyridinyl)carbazol-9-yl]-4-pyridinyl]benzonitrile
CID 146544320
9-(4-fluorophenyl)-N-[4-[4-(N-[9-(4-fluorophenyl)-9a-methyl-4aH-carbazol-3-yl]anilino)cyclohexa-1,3-dien-5-yn-1-yl]phenyl]-N-phenylcarbazol-3-amine
CID 146670324
3-[2,5-bis[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-pyridinyl]benzonitrile;3-[2,5-bis(2,7-diphenylcarbazol-9-yl)-4-pyridinyl]benzonitrile;3-[2,5-bis(2-phenylcarbazol-9-yl)-4-pyridinyl]benzonitrile;3-[2,5-bis(3-phenylcarbazol-9-yl)-4-pyridinyl]benzonitrile
CID 159913359
9-dibenzofuran-2-yl-N,N-bis(4-phenylphenyl)carbazol-3-amine;N,4-diphenyl-N-[4-[9-(6-phenyl-2-pyridinyl)carbazol-3-yl]phenyl]aniline;N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 159353145
3-(9-phenylcarbazol-3-yl)-9-[3-(6-phenyl-4-pyridin-4-yl-2-pyridinyl)phenyl]carbazole
CID 144537302
3-N,3-N,6-N,6-N-tetraphenyl-9-[2-[4-(6-phenyl-2-pyridinyl)phenyl]phenyl]carbazole-3,6-diamine
CID 138675153
CID 161047983
CID 161047983
4-[9-(2,6-naphthyridin-3-yl)carbazol-3-yl]-N,N-diphenylaniline
CID 118506865

Frequently Asked Questions

What is the IUPAC name of 9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine?
The IUPAC name of 9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine (CID 163677744) is 9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine.
What is the SMILES notation for 9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine?
The canonical SMILES for 9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine is CC12C=CC(N(c3ccccc3)c3ccccc3)=CC1c1cc(N(c3ccccc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5c(c4)c4cc(-n6c7ccccc7c7ccccc76)ccc4n5-c4cnc(-n5c6ccc(-n7c8ccccc8c8ccccc87)cc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)cc4-c4cccc(-c5cccc(-c6ccccc6)n5)c4)cc3)ccc1N2c1cc(-c2cccc(-c3ccncc3)c2)c(-n2c3ccc(N(c4ccccc4)c4ccccc4)cc3c3cc(N(c4ccccc4)c4ccccc4)ccc32)cn1.
What is the InChIKey of 9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine?
The InChIKey is JIEAWPUTEXUVOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C183H122N16/c1-183-102-99-143(190(132-57-20-7-21-58-132)133-59-22-8-23-60-133)115-161(183)160-114-138(90-98-178(160)199(183)182-117-152(125-46-40-45-123(105-125)121-100-103-184-104-101-121)180(119-186-182)197-172-92-84-136(188(128-49-12-3-13-50-128)129-51-14-4-15-52-129)108-154(172)155-109-137(85-93-173(155)197)189(130-53-16-5-17-54-130)131-55-18-6-19-56-131)191(134-61-24-9-25-62-134)135-82-79-120(80-83-135)124-81-91-171-153(107-124)150-69-32-39-78-170(150)195(171)142-87-95-175-157(111-142)156-110-139(192-164-72-33-26-63-144(164)145-64-27-34-73-165(145)192)86-94-174(156)196(175)179-118-185-181(116-151(179)126-47-41-48-127(106-126)163-71-42-70-162(187-163)122-43-10-2-11-44-122)198-176-96-88-140(193-166-74-35-28-65-146(166)147-66-29-36-75-167(147)193)112-158(176)159-113-141(89-97-177(159)198)194-168-76-37-30-67-148(168)149-68-31-38-77-169(149)194/h2-119,161H,1H3.
What are the key properties of 9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine?
9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine has a molecular weight of 2545.10 g/mol, XLogP of 47.64, 26 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-[6-(N-[4-[9-[6-carbazol-9-yl-9-[6-[3,6-di(carbazol-9-yl)carbazol-9-yl]-4-[3-(6-phenyl-2-pyridinyl)phenyl]-3-pyridinyl]carbazol-3-yl]carbazol-3-yl]phenyl]anilino)-9a-methyl-3-(N-phenylanilino)-4aH-carbazol-9-yl]-4-(3-pyridin-4-ylphenyl)-3-pyridinyl]-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine is sourced from PubChem (CID 163677744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).