2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole

C122H72N10 — CID 155477033

IUPAC2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole
SMILESc1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc(-c4cc5ccccc5c5c4c4ccccc4n5-c4ccc5c(c4)c4cc6ccccc6cc4n5-c4ccc(-c5nc(-c6ccccc6)nc(-c6cccc7ccccc67)n5)c5ccccc45)c4ccc(-n5c6ccccc6c6cc7cc(-n8c9ccccc9c9ccc%10ccccc%10c98)ccc7cc65)cc34)n2)cc1
InChIInChI=1S/C122H72N10/c1-3-29-76(30-4-1)117-123-119(83-51-50-73-26-7-8-33-78(73)64-83)127-122(124-117)100-60-59-93(92-58-55-86(71-102(92)100)129-107-47-22-20-44-96(107)103-68-84-65-85(54-52-81(84)70-112(103)129)130-108-48-23-19-43-95(108)97-57-53-75-28-12-15-39-89(75)115(97)130)106-67-82-36-13-16-40-90(82)116-114(106)101-45-21-24-49-109(101)131(116)87-56-62-111-105(72-87)104-66-79-34-9-10-35-80(79)69-113(104)132(111)110-63-61-99(91-41-17-18-42-94(91)110)121-126-118(77-31-5-2-6-32-77)125-120(128-121)98-46-25-37-74-27-11-14-38-88(74)98/h1-72H
InChIKeySVVRFZNJBKDCKD-UHFFFAOYSA-N
MW1677.99 g/mol
LogP31.34
Rot. Bonds11

About 2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole

2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole (PubChem CID 155477033) has the molecular formula C122H72N10 and a molecular weight of 1677.99 g/mol. Its IUPAC name is 2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole.

Molecular Properties

Compound Name2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole
PubChem CID155477033
Molecular FormulaC122H72N10
Molecular Weight1677.99 g/mol
Exact Mass1676.59
IUPAC Name2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole
SMILESc1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc(-c4cc5ccccc5c5c4c4ccccc4n5-c4ccc5c(c4)c4cc6ccccc6cc4n5-c4ccc(-c5nc(-c6ccccc6)nc(-c6cccc7ccccc67)n5)c5ccccc45)c4ccc(-n5c6ccccc6c6cc7cc(-n8c9ccccc9c9ccc%10ccccc%10c98)ccc7cc65)cc34)n2)cc1
InChIInChI=1S/C122H72N10/c1-3-29-76(30-4-1)117-123-119(83-51-50-73-26-7-8-33-78(73)64-83)127-122(124-117)100-60-59-93(92-58-55-86(71-102(92)100)129-107-47-22-20-44-96(107)103-68-84-65-85(54-52-81(84)70-112(103)129)130-108-48-23-19-43-95(108)97-57-53-75-28-12-15-39-89(75)115(97)130)106-67-82-36-13-16-40-90(82)116-114(106)101-45-21-24-49-109(101)131(116)87-56-62-111-105(72-87)104-66-79-34-9-10-35-80(79)69-113(104)132(111)110-63-61-99(91-41-17-18-42-94(91)110)121-126-118(77-31-5-2-6-32-77)125-120(128-121)98-46-25-37-74-27-11-14-38-88(74)98/h1-72H
InChIKeySVVRFZNJBKDCKD-UHFFFAOYSA-N
XLogP31.34
TPSA97.06 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds11
Heavy Atoms132
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001677.99
LogP ≤ 531.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole with MolForge

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Related Compounds

9-benzo[a]carbazol-11-yl-5-[8-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]benzo[b]carbazole;11-benzo[a]carbazol-11-yl-5-[5-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;9-benzo[a]carbazol-11-yl-5-[8-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]benzo[b]carbazole
CID 158213992
9-benzo[a]carbazol-11-yl-5-[1-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]benzo[b]carbazole;9-benzo[a]carbazol-11-yl-5-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]benzo[b]carbazole;11-benzo[a]carbazol-11-yl-5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole
CID 157209849
1-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;2-benzo[a]carbazol-11-yl-5-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole;6-benzo[a]carbazol-11-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole
CID 158646721
9-benzo[c]carbazol-7-yl-5-[4-(4-phenanthren-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole
CID 155477237
2-benzo[c]carbazol-7-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;9-benzo[c]carbazol-7-yl-5-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]benzo[b]carbazole;11-benzo[c]carbazol-7-yl-5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole
CID 159716086
12-[4-[4-phenyl-6-(9-phenylcarbazol-3-yl)-1,3,5-triazin-2-yl]naphthalen-1-yl]-12-azapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaene
CID 166915654
9-[5-[4-naphthalen-2-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[5-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole;9-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]carbazole
CID 165105451
9-benzo[b]carbazol-5-yl-5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;10-benzo[b]carbazol-5-yl-5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole
CID 158803382
5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-12-naphthalen-2-ylindolo[3,2-c]carbazole
CID 156530949
22-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-12-naphthalen-2-yl-12,22-diazahexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene;9-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-24-phenyl-9,24-diazahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaene;22-[5-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-12-phenyl-12,22-diazahexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene
CID 158569243
2-benzo[a]carbazol-11-yl-5-[2-(4-phenanthren-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;3-benzo[a]carbazol-11-yl-5-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole;11-benzo[a]carbazol-11-yl-5-[7-(4-phenanthren-3-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]benzo[b]carbazole
CID 161449551
12-[3-naphthalen-1-yl-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-12-azapentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14,16,18,20-decaene
CID 155450678

Frequently Asked Questions

What is the IUPAC name of 2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole?
The IUPAC name of 2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole (CID 155477033) is 2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole.
What is the SMILES notation for 2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole?
The canonical SMILES for 2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole is c1ccc(-c2nc(-c3ccc4ccccc4c3)nc(-c3ccc(-c4cc5ccccc5c5c4c4ccccc4n5-c4ccc5c(c4)c4cc6ccccc6cc4n5-c4ccc(-c5nc(-c6ccccc6)nc(-c6cccc7ccccc67)n5)c5ccccc45)c4ccc(-n5c6ccccc6c6cc7cc(-n8c9ccccc9c9ccc%10ccccc%10c98)ccc7cc65)cc34)n2)cc1.
What is the InChIKey of 2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole?
The InChIKey is SVVRFZNJBKDCKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C122H72N10/c1-3-29-76(30-4-1)117-123-119(83-51-50-73-26-7-8-33-78(73)64-83)127-122(124-117)100-60-59-93(92-58-55-86(71-102(92)100)129-107-47-22-20-44-96(107)103-68-84-65-85(54-52-81(84)70-112(103)129)130-108-48-23-19-43-95(108)97-57-53-75-28-12-15-39-89(75)115(97)130)106-67-82-36-13-16-40-90(82)116-114(106)101-45-21-24-49-109(101)131(116)87-56-62-111-105(72-87)104-66-79-34-9-10-35-80(79)69-113(104)132(111)110-63-61-99(91-41-17-18-42-94(91)110)121-126-118(77-31-5-2-6-32-77)125-120(128-121)98-46-25-37-74-27-11-14-38-88(74)98/h1-72H.
What are the key properties of 2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole?
2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole has a molecular weight of 1677.99 g/mol, XLogP of 31.34, 11 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[6-(9-benzo[a]carbazol-11-ylbenzo[b]carbazol-5-yl)-4-(4-naphthalen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[a]carbazol-11-yl]-5-[4-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole is sourced from PubChem (CID 155477033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).