2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine

C45H32FNO — CID 71003823

IUPAC2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine
SMILESCC1(C)c2cc(-c3ccccc3)ccc2N(c2ccc(-c3ccc(F)cc3)cc2)c2ccc(-c3ccc4oc5ccccc5c4c3)cc21
InChIInChI=1S/C45H32FNO/c1-45(2)39-27-33(29-8-4-3-5-9-29)16-23-41(39)47(36-21-14-31(15-22-36)30-12-19-35(46)20-13-30)42-24-17-34(28-40(42)45)32-18-25-44-38(26-32)37-10-6-7-11-43(37)48-44/h3-28H,1-2H3
InChIKeyZXLQPMMUOWPGJT-UHFFFAOYSA-N
MW621.76 g/mol
LogP12.84
Rot. Bonds4

About 2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine

2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine (PubChem CID 71003823) has the molecular formula C45H32FNO and a molecular weight of 621.76 g/mol. Its IUPAC name is 2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine.

Molecular Properties

Compound Name2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine
PubChem CID71003823
Molecular FormulaC45H32FNO
Molecular Weight621.76 g/mol
Exact Mass621.25
IUPAC Name2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine
SMILESCC1(C)c2cc(-c3ccccc3)ccc2N(c2ccc(-c3ccc(F)cc3)cc2)c2ccc(-c3ccc4oc5ccccc5c4c3)cc21
InChIInChI=1S/C45H32FNO/c1-45(2)39-27-33(29-8-4-3-5-9-29)16-23-41(39)47(36-21-14-31(15-22-36)30-12-19-35(46)20-13-30)42-24-17-34(28-40(42)45)32-18-25-44-38(26-32)37-10-6-7-11-43(37)48-44/h3-28H,1-2H3
InChIKeyZXLQPMMUOWPGJT-UHFFFAOYSA-N
XLogP12.84
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500621.76
LogP ≤ 512.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(10-dibenzofuran-2-yl-9,9-dimethylacridin-2-yl)-9,9-dimethyl-10-phenylacridine
CID 70936026
10-[3-(3-dibenzofuran-2-ylphenyl)phenyl]-9,9-dimethyl-2-phenylacridine
CID 71003986
2-dibenzofuran-4-yl-9,9-dimethyl-7-phenyl-10-(4-phenylphenyl)acridine
CID 70936203
7-dibenzofuran-2-yl-9,9-dimethyl-N-phenanthren-3-yl-N-phenyl-10-(4-phenylphenyl)acridin-2-amine
CID 118122889
3-dibenzofuran-2-yl-7-fluoro-10-(4-phenylphenyl)phenothiazine
CID 71003998
17-dibenzofuran-2-yl-21-(9,9-dimethylfluoren-2-yl)-24,24-dimethyl-17-azahexacyclo[12.12.0.02,7.08,13.016,25.018,23]hexacosa-1(26),2,4,6,8,10,12,14,16(25),18(23),19,21-dodecaene
CID 144635189
10-(7-dibenzofuran-2-yl-9,9-dimethylfluoren-2-yl)phenoxazine
CID 145009575
2-phenyl-7-(8,8,14,14-tetramethyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9,11,13(21),15,17,19-nonaen-5-yl)xanthen-9-one
CID 168812429
9-[4-(11,11-dimethylfluoreno[3,2-b][1]benzofuran-9-yl)phenyl]-3,6-diphenylcarbazole
CID 118098891
2-[4-[6-(4-fluorophenyl)naphthalen-2-yl]phenyl]dibenzofuran
CID 169293505
10-[8-[2-[8-(9,9-dimethylacridin-10-yl)dibenzofuran-2-yl]phenyl]dibenzofuran-2-yl]-9,9-dimethylacridine
CID 90352239
10-[4-[4-(4-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine;10-[4-[4,6-di(dibenzofuran-2-yl)-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine;9,9-dimethyl-10-[4-[4-(4-methylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]acridine
CID 159018235

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine?
The IUPAC name of 2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine (CID 71003823) is 2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine.
What is the SMILES notation for 2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine?
The canonical SMILES for 2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine is CC1(C)c2cc(-c3ccccc3)ccc2N(c2ccc(-c3ccc(F)cc3)cc2)c2ccc(-c3ccc4oc5ccccc5c4c3)cc21.
What is the InChIKey of 2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine?
The InChIKey is ZXLQPMMUOWPGJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H32FNO/c1-45(2)39-27-33(29-8-4-3-5-9-29)16-23-41(39)47(36-21-14-31(15-22-36)30-12-19-35(46)20-13-30)42-24-17-34(28-40(42)45)32-18-25-44-38(26-32)37-10-6-7-11-43(37)48-44/h3-28H,1-2H3.
What are the key properties of 2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine?
2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine has a molecular weight of 621.76 g/mol, XLogP of 12.84, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-2-yl-10-[4-(4-fluorophenyl)phenyl]-9,9-dimethyl-7-phenylacridine is sourced from PubChem (CID 71003823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).