2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole

C162H125N9 — CID 137420903

IUPAC2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole
SMILESCc1ccc2c(c1)c1ccc(-c3ccc4c5cc(C)ccc5n(-c5ccc6c7cc(CC(C)(C)c8ccc9c(c8)c8ccc(-c%10ccc%11c%12cc(C(C)(C)C)ccc%12n(-c%12ccccc%12)c%11c%10)cc8n9-c8ccc9c%10cc(CC(C)(C)c%11ccc%12c(c%11)c%11ccc(-c%13ccc%14c%15cc(C(C)(C)C)ccc%15n(-c%15ccccc%15)c%14c%13)cc%11n%12-c%11ccc%12c%13ccccc%13n(-c%13ccccc%13)c%12c%11)ccc%10n(-c%10ccccc%10)c9c8)ccc7n(-c7ccccc7)c6c5)c4c3)cc1n2-c1ccccc1
InChIInChI=1S/C162H125N9/c1-100-47-73-142-133(81-100)125-64-51-104(85-150(125)164(142)115-35-21-14-22-36-115)107-52-65-126-134-82-101(2)48-74-143(134)169(153(126)88-107)121-62-71-131-135-83-102(49-75-144(135)167(157(131)96-121)118-41-27-17-28-42-118)98-162(11,12)113-60-80-149-140(94-113)130-69-56-109(106-54-67-128-138-92-111(160(6,7)8)58-78-147(138)166(152(128)87-106)117-39-25-16-26-40-117)90-155(130)171(149)122-63-72-132-136-84-103(50-76-145(136)168(158(132)97-122)119-43-29-18-30-44-119)99-161(9,10)112-59-79-148-139(93-112)129-68-55-108(105-53-66-127-137-91-110(159(3,4)5)57-77-146(137)165(151(127)86-105)116-37-23-15-24-38-116)89-154(129)170(148)120-61-70-124-123-45-31-32-46-141(123)163(156(124)95-120)114-33-19-13-20-34-114/h13-97H,98-99H2,1-12H3
InChIKeyHZDMTLDSZBBVPP-UHFFFAOYSA-N
MW2197.84 g/mol
LogP42.81
Rot. Bonds18

About 2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole

2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole (PubChem CID 137420903) has the molecular formula C162H125N9 and a molecular weight of 2197.84 g/mol. Its IUPAC name is 2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole.

Molecular Properties

Compound Name2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole
PubChem CID137420903
Molecular FormulaC162H125N9
Molecular Weight2197.84 g/mol
Exact Mass2196.01
IUPAC Name2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole
SMILESCc1ccc2c(c1)c1ccc(-c3ccc4c5cc(C)ccc5n(-c5ccc6c7cc(CC(C)(C)c8ccc9c(c8)c8ccc(-c%10ccc%11c%12cc(C(C)(C)C)ccc%12n(-c%12ccccc%12)c%11c%10)cc8n9-c8ccc9c%10cc(CC(C)(C)c%11ccc%12c(c%11)c%11ccc(-c%13ccc%14c%15cc(C(C)(C)C)ccc%15n(-c%15ccccc%15)c%14c%13)cc%11n%12-c%11ccc%12c%13ccccc%13n(-c%13ccccc%13)c%12c%11)ccc%10n(-c%10ccccc%10)c9c8)ccc7n(-c7ccccc7)c6c5)c4c3)cc1n2-c1ccccc1
InChIInChI=1S/C162H125N9/c1-100-47-73-142-133(81-100)125-64-51-104(85-150(125)164(142)115-35-21-14-22-36-115)107-52-65-126-134-82-101(2)48-74-143(134)169(153(126)88-107)121-62-71-131-135-83-102(49-75-144(135)167(157(131)96-121)118-41-27-17-28-42-118)98-162(11,12)113-60-80-149-140(94-113)130-69-56-109(106-54-67-128-138-92-111(160(6,7)8)58-78-147(138)166(152(128)87-106)117-39-25-16-26-40-117)90-155(130)171(149)122-63-72-132-136-84-103(50-76-145(136)168(158(132)97-122)119-43-29-18-30-44-119)99-161(9,10)112-59-79-148-139(93-112)129-68-55-108(105-53-66-127-137-91-110(159(3,4)5)57-77-146(137)165(151(127)86-105)116-37-23-15-24-38-116)89-154(129)170(148)120-61-70-124-123-45-31-32-46-141(123)163(156(124)95-120)114-33-19-13-20-34-114/h13-97H,98-99H2,1-12H3
InChIKeyHZDMTLDSZBBVPP-UHFFFAOYSA-N
XLogP42.81
TPSA44.37 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds18
Heavy Atoms171
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002197.84
LogP ≤ 542.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole with MolForge

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Related Compounds

9-(4-tert-butylphenyl)-3,6-di(carbazol-9-yl)carbazole;3,6-ditert-butyl-9-[6-(3,6-ditert-butylcarbazol-9-yl)-9-phenylcarbazol-3-yl]carbazole;3,6-di(carbazol-9-yl)-9-(4-methylphenyl)carbazole
CID 158450509
2,7-bis(3,6-ditert-butylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazole
CID 121355698
N-[4-(3,6-ditert-butylcarbazol-9-yl)phenyl]-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline;N-[4-(3,6-diethylcarbazol-9-yl)phenyl]-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline;N-[4-(3,6-dimethylcarbazol-9-yl)phenyl]-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline
CID 159264899
2-tert-butyl-9-phenylcarbazole;3-tert-butyl-9-phenylcarbazole;3-tert-butyl-9-(9-phenylcarbazol-3-yl)carbazole;9-(4-tert-butylphenyl)-3-carbazol-9-ylcarbazole;3-tert-butyl-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole
CID 159742903
9-[4-(4-tert-butylphenyl)phenyl]-2-(4-methylphenyl)-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 170073064
6-methyl-2-(9-phenylcarbazol-3-yl)-9-triphenylen-2-ylcarbazole
CID 118330173
2-[9-(4-methylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 135248578
3-carbazol-9-yl-6-methyl-9-phenylcarbazole;2-(3-methylcarbazol-9-yl)-9-phenylcarbazole
CID 158584509
3-[3-[9-[9-[3,5-bis(2,2-dimethylpropyl)phenyl]-6-carbazol-9-ylcarbazol-3-yl]carbazol-3-yl]carbazol-9-yl]-6-(3-tert-butylcarbazol-9-yl)-9-phenylcarbazole
CID 126723707
9-(3-tert-butylphenyl)-2-[9-(4-tert-butylphenyl)carbazol-2-yl]carbazole
CID 126685172
3-(3-tert-butylcarbazol-9-yl)-6-carbazol-9-yl-9-phenylcarbazole
CID 59399314
9-[4-[2-tert-butyl-10-(4-methylphenyl)anthracen-9-yl]phenyl]carbazole
CID 58991829

Frequently Asked Questions

What is the IUPAC name of 2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole?
The IUPAC name of 2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole (CID 137420903) is 2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole.
What is the SMILES notation for 2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole?
The canonical SMILES for 2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole is Cc1ccc2c(c1)c1ccc(-c3ccc4c5cc(C)ccc5n(-c5ccc6c7cc(CC(C)(C)c8ccc9c(c8)c8ccc(-c%10ccc%11c%12cc(C(C)(C)C)ccc%12n(-c%12ccccc%12)c%11c%10)cc8n9-c8ccc9c%10cc(CC(C)(C)c%11ccc%12c(c%11)c%11ccc(-c%13ccc%14c%15cc(C(C)(C)C)ccc%15n(-c%15ccccc%15)c%14c%13)cc%11n%12-c%11ccc%12c%13ccccc%13n(-c%13ccccc%13)c%12c%11)ccc%10n(-c%10ccccc%10)c9c8)ccc7n(-c7ccccc7)c6c5)c4c3)cc1n2-c1ccccc1.
What is the InChIKey of 2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole?
The InChIKey is HZDMTLDSZBBVPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C162H125N9/c1-100-47-73-142-133(81-100)125-64-51-104(85-150(125)164(142)115-35-21-14-22-36-115)107-52-65-126-134-82-101(2)48-74-143(134)169(153(126)88-107)121-62-71-131-135-83-102(49-75-144(135)167(157(131)96-121)118-41-27-17-28-42-118)98-162(11,12)113-60-80-149-140(94-113)130-69-56-109(106-54-67-128-138-92-111(160(6,7)8)58-78-147(138)166(152(128)87-106)117-39-25-16-26-40-117)90-155(130)171(149)122-63-72-132-136-84-103(50-76-145(136)168(158(132)97-122)119-43-29-18-30-44-119)99-161(9,10)112-59-79-148-139(93-112)129-68-55-108(105-53-66-127-137-91-110(159(3,4)5)57-77-146(137)165(151(127)86-105)116-37-23-15-24-38-116)89-154(129)170(148)120-61-70-124-123-45-31-32-46-141(123)163(156(124)95-120)114-33-19-13-20-34-114/h13-97H,98-99H2,1-12H3.
What are the key properties of 2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole?
2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole has a molecular weight of 2197.84 g/mol, XLogP of 42.81, 18 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-[6-[2-[7-(6-tert-butyl-9-phenylcarbazol-2-yl)-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-2-methylpropyl]-9-phenylcarbazol-2-yl]-6-[2-methyl-1-[7-[6-methyl-2-(6-methyl-9-phenylcarbazol-2-yl)carbazol-9-yl]-9-phenylcarbazol-3-yl]propan-2-yl]carbazole is sourced from PubChem (CID 137420903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).