6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole

C154H96N6 — CID 134556038

IUPAC6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole
SMILESc1ccc(-c2ccc(-c3c4ccccc4cc4c5ccccc5n(-c5ccc6c(c5)c5ccccc5n6-c5ccc6ccc(-c7cccc8c7c7cc9ccccc9c(-c9ccc(-c%10ccccc%10)cc9)c7n8-c7ccc8c(c7)c7ccccc7n8-c7ccc(-c8cccc(-c9ccc%10c(c9)c9cc%11ccccc%11c(-c%11ccc(-c%12ccccc%12)cc%11)c9n%10-c9ccc%10c%11ccccc%11n(-c%11ccc(-c%12ccccc%12)cc%11)c%10c9)c8)cc7)cc6c5)c34)cc2)cc1
InChIInChI=1S/C154H96N6/c1-5-29-97(30-6-1)101-55-62-107(63-56-101)148-124-42-16-13-37-113(124)91-136-131-48-22-26-53-142(131)158(152(136)148)121-81-86-144-135(94-121)130-47-21-25-52-141(130)157(144)120-79-73-106-61-68-116(88-117(106)89-120)127-49-28-54-146-151(127)138-93-115-39-15-18-44-126(115)150(109-66-59-103(60-67-109)99-33-9-3-10-34-99)154(138)160(146)122-82-85-143-134(95-122)129-46-20-24-51-140(129)155(143)118-77-71-105(72-78-118)110-40-27-41-111(87-110)112-74-84-145-133(90-112)137-92-114-38-14-17-43-125(114)149(108-64-57-102(58-65-108)98-31-7-2-8-32-98)153(137)159(145)123-80-83-132-128-45-19-23-50-139(128)156(147(132)96-123)119-75-69-104(70-76-119)100-35-11-4-12-36-100/h1-96H
InChIKeyHKFXOCQLNRKVBO-UHFFFAOYSA-N
MW2030.50 g/mol
LogP41.55
Rot. Bonds16

About 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole

6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole (PubChem CID 134556038) has the molecular formula C154H96N6 and a molecular weight of 2030.50 g/mol. Its IUPAC name is 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole.

Molecular Properties

Compound Name6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole
PubChem CID134556038
Molecular FormulaC154H96N6
Molecular Weight2030.50 g/mol
Exact Mass2028.77
IUPAC Name6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole
SMILESc1ccc(-c2ccc(-c3c4ccccc4cc4c5ccccc5n(-c5ccc6c(c5)c5ccccc5n6-c5ccc6ccc(-c7cccc8c7c7cc9ccccc9c(-c9ccc(-c%10ccccc%10)cc9)c7n8-c7ccc8c(c7)c7ccccc7n8-c7ccc(-c8cccc(-c9ccc%10c(c9)c9cc%11ccccc%11c(-c%11ccc(-c%12ccccc%12)cc%11)c9n%10-c9ccc%10c%11ccccc%11n(-c%11ccc(-c%12ccccc%12)cc%11)c%10c9)c8)cc7)cc6c5)c34)cc2)cc1
InChIInChI=1S/C154H96N6/c1-5-29-97(30-6-1)101-55-62-107(63-56-101)148-124-42-16-13-37-113(124)91-136-131-48-22-26-53-142(131)158(152(136)148)121-81-86-144-135(94-121)130-47-21-25-52-141(130)157(144)120-79-73-106-61-68-116(88-117(106)89-120)127-49-28-54-146-151(127)138-93-115-39-15-18-44-126(115)150(109-66-59-103(60-67-109)99-33-9-3-10-34-99)154(138)160(146)122-82-85-143-134(95-122)129-46-20-24-51-140(129)155(143)118-77-71-105(72-78-118)110-40-27-41-111(87-110)112-74-84-145-133(90-112)137-92-114-38-14-17-43-125(114)149(108-64-57-102(58-65-108)98-31-7-2-8-32-98)153(137)159(145)123-80-83-132-128-45-19-23-50-139(128)156(147(132)96-123)119-75-69-104(70-76-119)100-35-11-4-12-36-100/h1-96H
InChIKeyHKFXOCQLNRKVBO-UHFFFAOYSA-N
XLogP41.55
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds16
Heavy Atoms160
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002030.50
LogP ≤ 541.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole?
The IUPAC name of 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole (CID 134556038) is 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole.
What is the SMILES notation for 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole?
The canonical SMILES for 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole is c1ccc(-c2ccc(-c3c4ccccc4cc4c5ccccc5n(-c5ccc6c(c5)c5ccccc5n6-c5ccc6ccc(-c7cccc8c7c7cc9ccccc9c(-c9ccc(-c%10ccccc%10)cc9)c7n8-c7ccc8c(c7)c7ccccc7n8-c7ccc(-c8cccc(-c9ccc%10c(c9)c9cc%11ccccc%11c(-c%11ccc(-c%12ccccc%12)cc%11)c9n%10-c9ccc%10c%11ccccc%11n(-c%11ccc(-c%12ccccc%12)cc%11)c%10c9)c8)cc7)cc6c5)c34)cc2)cc1.
What is the InChIKey of 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole?
The InChIKey is HKFXOCQLNRKVBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C154H96N6/c1-5-29-97(30-6-1)101-55-62-107(63-56-101)148-124-42-16-13-37-113(124)91-136-131-48-22-26-53-142(131)158(152(136)148)121-81-86-144-135(94-121)130-47-21-25-52-141(130)157(144)120-79-73-106-61-68-116(88-117(106)89-120)127-49-28-54-146-151(127)138-93-115-39-15-18-44-126(115)150(109-66-59-103(60-67-109)99-33-9-3-10-34-99)154(138)160(146)122-82-85-143-134(95-122)129-46-20-24-51-140(129)155(143)118-77-71-105(72-78-118)110-40-27-41-111(87-110)112-74-84-145-133(90-112)137-92-114-38-14-17-43-125(114)149(108-64-57-102(58-65-108)98-31-7-2-8-32-98)153(137)159(145)123-80-83-132-128-45-19-23-50-139(128)156(147(132)96-123)119-75-69-104(70-76-119)100-35-11-4-12-36-100/h1-96H.
What are the key properties of 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole?
6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole has a molecular weight of 2030.50 g/mol, XLogP of 41.55, 16 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-phenylphenyl)-1-[7-[3-[6-(4-phenylphenyl)benzo[b]carbazol-5-yl]carbazol-9-yl]naphthalen-2-yl]-5-[9-[4-[3-[6-(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-2-yl]benzo[b]carbazol-2-yl]phenyl]phenyl]carbazol-3-yl]benzo[b]carbazole is sourced from PubChem (CID 134556038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).