3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole

C128H133N7 — CID 59411991

IUPAC3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole
SMILESCc1nc(-c2ccc(CCCc3ccc4c(c3)c3cc(-c5ccc6c(c5)C(CC(C)C)(CC(C)C)c5cc(-c7ccc8c(c7)c7ccccc7n8CC(C)C)ccc5-6)ccc3n4CC(C)C)cc2)nc(-c2ccc(CCCc3ccc4c(c3)c3cc(-c5ccc6c(c5)C(CC(C)C)(CC(C)C)c5cc(-c7ccc8c(c7)c7ccccc7n8CC(C)C)ccc5-6)ccc3n4CC(C)C)cc2)n1
InChIInChI=1S/C128H133N7/c1-78(2)70-127(71-79(3)4)113-66-97(93-46-56-121-109(62-93)105-28-18-20-30-117(105)132(121)74-82(9)10)42-50-101(113)103-52-44-99(68-115(103)127)95-48-58-123-111(64-95)107-60-89(36-54-119(107)134(123)76-84(13)14)26-22-24-87-32-38-91(39-33-87)125-129-86(17)130-126(131-125)92-40-34-88(35-41-92)25-23-27-90-37-55-120-108(61-90)112-65-96(49-59-124(112)135(120)77-85(15)16)100-45-53-104-102-51-43-98(67-114(102)128(72-80(5)6,73-81(7)8)116(104)69-100)94-47-57-122-110(63-94)106-29-19-21-31-118(106)133(122)75-83(11)12/h18-21,28-69,78-85H,22-27,70-77H2,1-17H3
InChIKeyHPCGSYMLHXKINM-UHFFFAOYSA-N
MW1769.52 g/mol
LogP34.31
Rot. Bonds30

About 3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole

3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole (PubChem CID 59411991) has the molecular formula C128H133N7 and a molecular weight of 1769.52 g/mol. Its IUPAC name is 3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole.

Molecular Properties

Compound Name3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole
PubChem CID59411991
Molecular FormulaC128H133N7
Molecular Weight1769.52 g/mol
Exact Mass1768.06
IUPAC Name3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole
SMILESCc1nc(-c2ccc(CCCc3ccc4c(c3)c3cc(-c5ccc6c(c5)C(CC(C)C)(CC(C)C)c5cc(-c7ccc8c(c7)c7ccccc7n8CC(C)C)ccc5-6)ccc3n4CC(C)C)cc2)nc(-c2ccc(CCCc3ccc4c(c3)c3cc(-c5ccc6c(c5)C(CC(C)C)(CC(C)C)c5cc(-c7ccc8c(c7)c7ccccc7n8CC(C)C)ccc5-6)ccc3n4CC(C)C)cc2)n1
InChIInChI=1S/C128H133N7/c1-78(2)70-127(71-79(3)4)113-66-97(93-46-56-121-109(62-93)105-28-18-20-30-117(105)132(121)74-82(9)10)42-50-101(113)103-52-44-99(68-115(103)127)95-48-58-123-111(64-95)107-60-89(36-54-119(107)134(123)76-84(13)14)26-22-24-87-32-38-91(39-33-87)125-129-86(17)130-126(131-125)92-40-34-88(35-41-92)25-23-27-90-37-55-120-108(61-90)112-65-96(49-59-124(112)135(120)77-85(15)16)100-45-53-104-102-51-43-98(67-114(102)128(72-80(5)6,73-81(7)8)116(104)69-100)94-47-57-122-110(63-94)106-29-19-21-31-118(106)133(122)75-83(11)12/h18-21,28-69,78-85H,22-27,70-77H2,1-17H3
InChIKeyHPCGSYMLHXKINM-UHFFFAOYSA-N
XLogP34.31
TPSA58.39 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds30
Heavy Atoms135
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001769.52
LogP ≤ 534.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole?
The IUPAC name of 3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole (CID 59411991) is 3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole.
What is the SMILES notation for 3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole?
The canonical SMILES for 3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole is Cc1nc(-c2ccc(CCCc3ccc4c(c3)c3cc(-c5ccc6c(c5)C(CC(C)C)(CC(C)C)c5cc(-c7ccc8c(c7)c7ccccc7n8CC(C)C)ccc5-6)ccc3n4CC(C)C)cc2)nc(-c2ccc(CCCc3ccc4c(c3)c3cc(-c5ccc6c(c5)C(CC(C)C)(CC(C)C)c5cc(-c7ccc8c(c7)c7ccccc7n8CC(C)C)ccc5-6)ccc3n4CC(C)C)cc2)n1.
What is the InChIKey of 3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole?
The InChIKey is HPCGSYMLHXKINM-UHFFFAOYSA-N. The full InChI is InChI=1S/C128H133N7/c1-78(2)70-127(71-79(3)4)113-66-97(93-46-56-121-109(62-93)105-28-18-20-30-117(105)132(121)74-82(9)10)42-50-101(113)103-52-44-99(68-115(103)127)95-48-58-123-111(64-95)107-60-89(36-54-119(107)134(123)76-84(13)14)26-22-24-87-32-38-91(39-33-87)125-129-86(17)130-126(131-125)92-40-34-88(35-41-92)25-23-27-90-37-55-120-108(61-90)112-65-96(49-59-124(112)135(120)77-85(15)16)100-45-53-104-102-51-43-98(67-114(102)128(72-80(5)6,73-81(7)8)116(104)69-100)94-47-57-122-110(63-94)106-29-19-21-31-118(106)133(122)75-83(11)12/h18-21,28-69,78-85H,22-27,70-77H2,1-17H3.
What are the key properties of 3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole?
3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole has a molecular weight of 1769.52 g/mol, XLogP of 34.31, 30 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-6-[3-[4-[4-[4-[3-[6-[9,9-bis(2-methylpropyl)-7-[9-(2-methylpropyl)carbazol-3-yl]fluoren-2-yl]-9-(2-methylpropyl)carbazol-3-yl]propyl]phenyl]-6-methyl-1,3,5-triazin-2-yl]phenyl]propyl]-9-(2-methylpropyl)carbazole is sourced from PubChem (CID 59411991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).