10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine

C60H41N3 — CID 118231939

IUPAC10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine
SMILESc1ccc(-c2cc(-c3ccccc3)nc(N3c4ccccc4C(c4ccccc4)(c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4)c4ccccc43)c2)cc1
InChIInChI=1S/C60H41N3/c1-5-20-42(21-6-1)46-40-54(43-22-7-2-8-23-43)61-59(41-46)63-57-34-17-14-31-52(57)60(47-25-9-3-10-26-47,53-32-15-18-35-58(53)63)48-27-19-24-44(38-48)45-36-37-56-51(39-45)50-30-13-16-33-55(50)62(56)49-28-11-4-12-29-49/h1-41H
InChIKeyGXEPDEVBNBSGIP-UHFFFAOYSA-N
MW804.01 g/mol
LogP15.35
Rot. Bonds7

About 10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine

10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine (PubChem CID 118231939) has the molecular formula C60H41N3 and a molecular weight of 804.01 g/mol. Its IUPAC name is 10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine.

Molecular Properties

Compound Name10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine
PubChem CID118231939
Molecular FormulaC60H41N3
Molecular Weight804.01 g/mol
Exact Mass803.33
IUPAC Name10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine
SMILESc1ccc(-c2cc(-c3ccccc3)nc(N3c4ccccc4C(c4ccccc4)(c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4)c4ccccc43)c2)cc1
InChIInChI=1S/C60H41N3/c1-5-20-42(21-6-1)46-40-54(43-22-7-2-8-23-43)61-59(41-46)63-57-34-17-14-31-52(57)60(47-25-9-3-10-26-47,53-32-15-18-35-58(53)63)48-27-19-24-44(38-48)45-36-37-56-51(39-45)50-30-13-16-33-55(50)62(56)49-28-11-4-12-29-49/h1-41H
InChIKeyGXEPDEVBNBSGIP-UHFFFAOYSA-N
XLogP15.35
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms63
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500804.01
LogP ≤ 515.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

10-(4,6-diphenyl-2-pyridinyl)-2'-[9-(4-methylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene];10-(4,6-diphenyl-2-pyridinyl)-2'-(9-phenylcarbazol-3-yl)spiro[acridine-9,9'-fluorene];10-(4,6-diphenyl-2-pyridinyl)-2'-[9-(4-phenylphenyl)carbazol-3-yl]spiro[acridine-9,9'-fluorene]
CID 157249791
9-phenyl-9-(9-phenylcarbazol-3-yl)-10-[4-(9-phenylcarbazol-3-yl)phenyl]acridine
CID 146511276
3-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 71286913
3-(2,6-diphenyl-4-pyridinyl)-9-phenylcarbazole
CID 70934573
3-(9-phenylcarbazol-3-yl)-9-[2-[2-[4-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590363
3-(9-phenylcarbazol-3-yl)-9-[4-[4-[3-[9-[4-(2-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]carbazole
CID 154590784
3-[9-[3-[3-[4-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]phenyl]phenyl]carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 154590619
N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)-3-(9,9,10-triphenylacridin-3-yl)aniline;N-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-3-(9,9,10-triphenylacridin-3-yl)aniline;N-phenyl-3-(9-phenylcarbazol-3-yl)-N-[3-(9,9,10-triphenylacridin-3-yl)phenyl]aniline;N-(4-phenylphenyl)-N-(4-pyridin-4-ylphenyl)-3-(9,9,10-triphenylacridin-3-yl)aniline
CID 159826342
3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[3-[4-[4-[3-[9-[3-(4-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590364
9-dibenzothiophen-3-yl-9-phenyl-10-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]acridine
CID 146909198
3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(2,6-diphenyl-4-pyridinyl)carbazole;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4,6-diphenyl-2-pyridinyl)carbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 167712900
3-[9-(3-phenylphenyl)carbazol-3-yl]-9-[4-[4-[4-[3-[9-[4-(3-phenylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590519

Frequently Asked Questions

What is the IUPAC name of 10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine?
The IUPAC name of 10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine (CID 118231939) is 10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine.
What is the SMILES notation for 10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine?
The canonical SMILES for 10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine is c1ccc(-c2cc(-c3ccccc3)nc(N3c4ccccc4C(c4ccccc4)(c4cccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c4)c4ccccc43)c2)cc1.
What is the InChIKey of 10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine?
The InChIKey is GXEPDEVBNBSGIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H41N3/c1-5-20-42(21-6-1)46-40-54(43-22-7-2-8-23-43)61-59(41-46)63-57-34-17-14-31-52(57)60(47-25-9-3-10-26-47,53-32-15-18-35-58(53)63)48-27-19-24-44(38-48)45-36-37-56-51(39-45)50-30-13-16-33-55(50)62(56)49-28-11-4-12-29-49/h1-41H.
What are the key properties of 10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine?
10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine has a molecular weight of 804.01 g/mol, XLogP of 15.35, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(4,6-diphenyl-2-pyridinyl)-9-phenyl-9-[3-(9-phenylcarbazol-3-yl)phenyl]acridine is sourced from PubChem (CID 118231939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).