18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene

C136H82N8O — CID 155257402

IUPAC18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)c6ccccc6n7-c6ccc(-c7cccc(-c8cc(-n9c%10ccccc%10c%10cc(-c%11ccc%12c(c%11)c%11cc(-c%13cccc(-c%14nc(-n%15c%16ccccc%16c%16c%17c%18ccccc%18oc%17c%17ccccc%17c%16%15)nc%15ccccc%14%15)c%13)ccc%11n%12-c%11ccccc%11)ccc%109)cc9ccccc89)c7)cc6)ccc4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/C136H82N8O/c1-4-33-96(34-5-1)139-119-49-21-15-40-102(119)111-75-87(57-65-123(111)139)90-60-70-128-116(80-90)117-81-91(61-71-129(117)141(128)98-37-8-3-9-38-98)88-58-66-124-112(76-88)103-41-16-22-50-120(103)142(124)99-63-54-83(55-64-99)84-29-26-31-93(72-84)110-82-100(74-94-28-10-11-39-101(94)110)143-121-51-23-17-42-104(121)113-77-89(59-67-125(113)143)92-62-69-127-115(79-92)114-78-86(56-68-126(114)140(127)97-35-6-2-7-36-97)85-30-27-32-95(73-85)133-107-45-14-20-48-118(107)137-136(138-133)144-122-52-24-18-46-108(122)131-132-109-47-19-25-53-130(109)145-135(132)106-44-13-12-43-105(106)134(131)144/h1-82H
InChIKeyXQQOVJDSPHNFJB-UHFFFAOYSA-N
MW1844.21 g/mol
LogP36.09
Rot. Bonds13

About 18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene

18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene (PubChem CID 155257402) has the molecular formula C136H82N8O and a molecular weight of 1844.21 g/mol. Its IUPAC name is 18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene.

Molecular Properties

Compound Name18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene
PubChem CID155257402
Molecular FormulaC136H82N8O
Molecular Weight1844.21 g/mol
Exact Mass1842.66
IUPAC Name18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)c6ccccc6n7-c6ccc(-c7cccc(-c8cc(-n9c%10ccccc%10c%10cc(-c%11ccc%12c(c%11)c%11cc(-c%13cccc(-c%14nc(-n%15c%16ccccc%16c%16c%17c%18ccccc%18oc%17c%17ccccc%17c%16%15)nc%15ccccc%14%15)c%13)ccc%11n%12-c%11ccccc%11)ccc%109)cc9ccccc89)c7)cc6)ccc4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/C136H82N8O/c1-4-33-96(34-5-1)139-119-49-21-15-40-102(119)111-75-87(57-65-123(111)139)90-60-70-128-116(80-90)117-81-91(61-71-129(117)141(128)98-37-8-3-9-38-98)88-58-66-124-112(76-88)103-41-16-22-50-120(103)142(124)99-63-54-83(55-64-99)84-29-26-31-93(72-84)110-82-100(74-94-28-10-11-39-101(94)110)143-121-51-23-17-42-104(121)113-77-89(59-67-125(113)143)92-62-69-127-115(79-92)114-78-86(56-68-126(114)140(127)97-35-6-2-7-36-97)85-30-27-32-95(73-85)133-107-45-14-20-48-118(107)137-136(138-133)144-122-52-24-18-46-108(122)131-132-109-47-19-25-53-130(109)145-135(132)106-44-13-12-43-105(106)134(131)144/h1-82H
InChIKeyXQQOVJDSPHNFJB-UHFFFAOYSA-N
XLogP36.09
TPSA68.50 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds13
Heavy Atoms145
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001844.21
LogP ≤ 536.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene with MolForge

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Related Compounds

18-[4-[3-[6-(9-phenylcarbazol-3-yl)-9-(4-phenylquinazolin-2-yl)carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene
CID 146615811
18-[4-(6-phenylnaphthalen-2-yl)quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene
CID 118672666
5-[3-phenyl-5-[3-[3-[3-[3-[9-(4-phenylquinazolin-2-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]phenyl]phenyl]-[1]benzofuro[3,2-c]carbazole
CID 146215678
3-(9-phenylcarbazol-3-yl)-12-(4-phenylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole
CID 90050449
18-(4-dibenzofuran-2-ylquinazolin-2-yl)-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene
CID 118672656
5-[3-(9-phenylcarbazol-3-yl)phenyl]-12-(4-phenylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole;5-[4-(9-phenylcarbazol-2-yl)phenyl]-12-(4-phenylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole;5-[4-(9-phenylcarbazol-3-yl)phenyl]-12-(4-phenylquinazolin-2-yl)-[1]benzofuro[2,3-a]carbazole;6-[4-(9-phenylcarbazol-3-yl)phenyl]-5-(4-phenylquinazolin-2-yl)-[1]benzofuro[3,2-c]carbazole
CID 159057836
12-[4-(3-phenylphenyl)quinazolin-2-yl]-9-oxa-12-azaoctacyclo[18.12.0.02,10.03,8.011,19.013,18.021,26.027,32]dotriaconta-1(20),2(10),3,5,7,11(19),13,15,17,21,23,25,27,29,31-pentadecaene
CID 134359241
15-(4-phenylnaphthalen-2-yl)-24-(4-phenylphenyl)-11-oxa-15,24-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.018,23]heptacosa-1(16),2(14),3,5,7,9,12,17(25),18,20,22,26-dodecaene;15-(4-phenylphenyl)-24-(4-phenylquinazolin-2-yl)-6-oxa-15,24-diazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7,9,11,17(25),18,20,22,26-dodecaene;15-(4-phenylphenyl)-24-(4-phenylquinazolin-2-yl)-11-oxa-15,24-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.018,23]heptacosa-1(16),2(14),3,5,7,9,12,17(25),18,20,22,26-dodecaene
CID 158993888
18-[9-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-21-(4-phenylquinazolin-2-yl)-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene
CID 138475063
9-[4-[3-[9-[3-carbazol-9-yl-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-3-yl]phenyl]quinazolin-2-yl]-18-phenyl-9,18-diazahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene
CID 139492135
15-(4-dibenzofuran-3-ylquinazolin-2-yl)-10-(3,5-diphenylphenyl)-10,15-diazaheptacyclo[14.12.0.02,14.03,11.04,9.017,22.023,28]octacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,25,27-tridecaene;10-(3,5-diphenylphenyl)-15-(4,6-diphenyl-1,3,5-triazin-2-yl)-10,15-diazaheptacyclo[14.12.0.02,14.03,11.04,9.017,22.023,28]octacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,25,27-tridecaene;15-(3,5-diphenylphenyl)-10-(4,6-diphenyl-1,3,5-triazin-2-yl)-10,15-diazaheptacyclo[14.12.0.02,14.03,11.04,9.017,22.023,28]octacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,25,27-tridecaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-10,15-diazaheptacyclo[14.12.0.02,14.03,11.04,9.017,22.023,28]octacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,25,27-tridecaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-(3-phenylphenyl)-10,15-diazaheptacyclo[14.12.0.02,14.03,11.04,9.017,22.023,28]octacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,25,27-tridecaene;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-(4-phenylphenyl)-10,15-diazaheptacyclo[14.12.0.02,14.03,11.04,9.017,22.023,28]octacosa-1(16),2(14),3(11),4,6,8,12,17,19,21,23,25,27-tridecaene
CID 159033643
3-[4-(9-phenylcarbazol-3-yl)phenyl]-9-[4-(3-phenylphenyl)quinazolin-2-yl]carbazole
CID 118067227

Frequently Asked Questions

What is the IUPAC name of 18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene?
The IUPAC name of 18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene (CID 155257402) is 18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene.
What is the SMILES notation for 18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene?
The canonical SMILES for 18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene is c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cc(-c6ccc7c(c6)c6ccccc6n7-c6ccc(-c7cccc(-c8cc(-n9c%10ccccc%10c%10cc(-c%11ccc%12c(c%11)c%11cc(-c%13cccc(-c%14nc(-n%15c%16ccccc%16c%16c%17c%18ccccc%18oc%17c%17ccccc%17c%16%15)nc%15ccccc%14%15)c%13)ccc%11n%12-c%11ccccc%11)ccc%109)cc9ccccc89)c7)cc6)ccc4n5-c4ccccc4)ccc32)cc1.
What is the InChIKey of 18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene?
The InChIKey is XQQOVJDSPHNFJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C136H82N8O/c1-4-33-96(34-5-1)139-119-49-21-15-40-102(119)111-75-87(57-65-123(111)139)90-60-70-128-116(80-90)117-81-91(61-71-129(117)141(128)98-37-8-3-9-38-98)88-58-66-124-112(76-88)103-41-16-22-50-120(103)142(124)99-63-54-83(55-64-99)84-29-26-31-93(72-84)110-82-100(74-94-28-10-11-39-101(94)110)143-121-51-23-17-42-104(121)113-77-89(59-67-125(113)143)92-62-69-127-115(79-92)114-78-86(56-68-126(114)140(127)97-35-6-2-7-36-97)85-30-27-32-95(73-85)133-107-45-14-20-48-118(107)137-136(138-133)144-122-52-24-18-46-108(122)131-132-109-47-19-25-53-130(109)145-135(132)106-44-13-12-43-105(106)134(131)144/h1-82H.
What are the key properties of 18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene?
18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene has a molecular weight of 1844.21 g/mol, XLogP of 36.09, 13 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 18-[4-[3-[9-phenyl-6-[9-[4-[3-[4-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]phenyl]naphthalen-2-yl]carbazol-3-yl]carbazol-3-yl]phenyl]quinazolin-2-yl]-9-oxa-18-azahexacyclo[15.7.0.02,10.03,8.011,16.019,24]tetracosa-1(17),2(10),3,5,7,11,13,15,19,21,23-undecaene is sourced from PubChem (CID 155257402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).