10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole

C165H108N12 — CID 163797018

IUPAC10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole
SMILESCC1(C)c2ccccc2-c2cc(-c3nc(-n4c5ccc(-n6c7ccccc7c7cc8ccccc8cc76)cc5c5c6ccccc6ccc54)nc4ccccc34)ccc21.CC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5ccc(-n6c7ccccc7c7ccc8ccccc8c76)cc5c5c6ccccc6ccc54)nc4ccccc34)cc21.CC1(C)c2ccccc2-c2cccc(-c3nc(-n4c5ccc(-n6c7ccccc7c7cc8ccccc8cc76)cc5c5c6ccccc6ccc54)nc4ccccc34)c21
InChIInChI=1S/3C55H36N4/c1-55(2)45-20-10-7-17-39(45)40-27-24-35(31-46(40)55)52-43-19-8-11-21-47(43)56-54(57-52)59-49-30-26-36(32-44(49)51-37-15-5-3-13-33(37)25-29-50(51)59)58-48-22-12-9-18-41(48)42-28-23-34-14-4-6-16-38(34)53(42)58;1-55(2)45-23-10-7-18-38(45)40-21-13-22-42(52(40)55)53-41-20-8-11-24-46(41)56-54(57-53)59-48-29-27-36(32-44(48)51-37-17-6-5-14-33(37)26-28-49(51)59)58-47-25-12-9-19-39(47)43-30-34-15-3-4-16-35(34)31-50(43)58;1-55(2)45-20-10-7-17-39(45)42-30-36(23-26-46(42)55)53-41-19-8-11-21-47(41)56-54(57-53)59-49-28-25-37(32-44(49)52-38-16-6-5-13-33(38)24-27-50(52)59)58-48-22-12-9-18-40(48)43-29-34-14-3-4-15-35(34)31-51(43)58/h3*3-32H,1-2H3
InChIKeyNBRPATDPWKZAGF-UHFFFAOYSA-N
MW2258.76 g/mol
LogP42.31
Rot. Bonds9

About 10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole

10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole (PubChem CID 163797018) has the molecular formula C165H108N12 and a molecular weight of 2258.76 g/mol. Its IUPAC name is 10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole.

Molecular Properties

Compound Name10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole
PubChem CID163797018
Molecular FormulaC165H108N12
Molecular Weight2258.76 g/mol
Exact Mass2256.88
IUPAC Name10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole
SMILESCC1(C)c2ccccc2-c2cc(-c3nc(-n4c5ccc(-n6c7ccccc7c7cc8ccccc8cc76)cc5c5c6ccccc6ccc54)nc4ccccc34)ccc21.CC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5ccc(-n6c7ccccc7c7ccc8ccccc8c76)cc5c5c6ccccc6ccc54)nc4ccccc34)cc21.CC1(C)c2ccccc2-c2cccc(-c3nc(-n4c5ccc(-n6c7ccccc7c7cc8ccccc8cc76)cc5c5c6ccccc6ccc54)nc4ccccc34)c21
InChIInChI=1S/3C55H36N4/c1-55(2)45-20-10-7-17-39(45)40-27-24-35(31-46(40)55)52-43-19-8-11-21-47(43)56-54(57-52)59-49-30-26-36(32-44(49)51-37-15-5-3-13-33(37)25-29-50(51)59)58-48-22-12-9-18-41(48)42-28-23-34-14-4-6-16-38(34)53(42)58;1-55(2)45-23-10-7-18-38(45)40-21-13-22-42(52(40)55)53-41-20-8-11-24-46(41)56-54(57-53)59-48-29-27-36(32-44(48)51-37-17-6-5-14-33(37)26-28-49(51)59)58-47-25-12-9-19-39(47)43-30-34-15-3-4-16-35(34)31-50(43)58;1-55(2)45-20-10-7-17-39(45)42-30-36(23-26-46(42)55)53-41-19-8-11-21-47(41)56-54(57-53)59-49-28-25-37(32-44(49)52-38-16-6-5-13-33(38)24-27-50(52)59)58-48-22-12-9-18-40(48)43-29-34-14-3-4-15-35(34)31-51(43)58/h3*3-32H,1-2H3
InChIKeyNBRPATDPWKZAGF-UHFFFAOYSA-N
XLogP42.31
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds9
Heavy Atoms177
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002258.76
LogP ≤ 542.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole?
The IUPAC name of 10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole (CID 163797018) is 10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole.
What is the SMILES notation for 10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole?
The canonical SMILES for 10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole is CC1(C)c2ccccc2-c2cc(-c3nc(-n4c5ccc(-n6c7ccccc7c7cc8ccccc8cc76)cc5c5c6ccccc6ccc54)nc4ccccc34)ccc21.CC1(C)c2ccccc2-c2ccc(-c3nc(-n4c5ccc(-n6c7ccccc7c7ccc8ccccc8c76)cc5c5c6ccccc6ccc54)nc4ccccc34)cc21.CC1(C)c2ccccc2-c2cccc(-c3nc(-n4c5ccc(-n6c7ccccc7c7cc8ccccc8cc76)cc5c5c6ccccc6ccc54)nc4ccccc34)c21.
What is the InChIKey of 10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole?
The InChIKey is NBRPATDPWKZAGF-UHFFFAOYSA-N. The full InChI is InChI=1S/3C55H36N4/c1-55(2)45-20-10-7-17-39(45)40-27-24-35(31-46(40)55)52-43-19-8-11-21-47(43)56-54(57-52)59-49-30-26-36(32-44(49)51-37-15-5-3-13-33(37)25-29-50(51)59)58-48-22-12-9-18-41(48)42-28-23-34-14-4-6-16-38(34)53(42)58;1-55(2)45-23-10-7-18-38(45)40-21-13-22-42(52(40)55)53-41-20-8-11-24-46(41)56-54(57-53)59-48-29-27-36(32-44(48)51-37-17-6-5-14-33(37)26-28-49(51)59)58-47-25-12-9-19-39(47)43-30-34-15-3-4-16-35(34)31-50(43)58;1-55(2)45-20-10-7-17-39(45)42-30-36(23-26-46(42)55)53-41-19-8-11-21-47(41)56-54(57-53)59-49-28-25-37(32-44(49)52-38-16-6-5-13-33(38)24-27-50(52)59)58-48-22-12-9-18-40(48)43-29-34-14-3-4-15-35(34)31-51(43)58/h3*3-32H,1-2H3.
What are the key properties of 10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole?
10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole has a molecular weight of 2258.76 g/mol, XLogP of 42.31, 9 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 10-benzo[a]carbazol-11-yl-7-[4-(9,9-dimethylfluoren-2-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-1-yl)quinazolin-2-yl]benzo[c]carbazole;10-benzo[b]carbazol-5-yl-7-[4-(9,9-dimethylfluoren-3-yl)quinazolin-2-yl]benzo[c]carbazole is sourced from PubChem (CID 163797018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).