12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole

C34H21NO — CID 118502601

IUPAC12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole
SMILESc1ccc(-c2cccc3cc(-n4c5ccccc5c5ccc6c7ccccc7oc6c54)ccc23)cc1
InChIInChI=1S/C34H21NO/c1-2-9-22(10-3-1)25-14-8-11-23-21-24(17-18-26(23)25)35-31-15-6-4-12-27(31)29-19-20-30-28-13-5-7-16-32(28)36-34(30)33(29)35/h1-21H
InChIKeyGDFFBICOTRTCQQ-UHFFFAOYSA-N
MW459.55 g/mol
LogP9.50
Rot. Bonds2

About 12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole

12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole (PubChem CID 118502601) has the molecular formula C34H21NO and a molecular weight of 459.55 g/mol. Its IUPAC name is 12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole.

Molecular Properties

Compound Name12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole
PubChem CID118502601
Molecular FormulaC34H21NO
Molecular Weight459.55 g/mol
Exact Mass459.16
IUPAC Name12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole
SMILESc1ccc(-c2cccc3cc(-n4c5ccccc5c5ccc6c7ccccc7oc6c54)ccc23)cc1
InChIInChI=1S/C34H21NO/c1-2-9-22(10-3-1)25-14-8-11-23-21-24(17-18-26(23)25)35-31-15-6-4-12-27(31)29-19-20-30-28-13-5-7-16-32(28)36-34(30)33(29)35/h1-21H
InChIKeyGDFFBICOTRTCQQ-UHFFFAOYSA-N
XLogP9.50
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500459.55
LogP ≤ 59.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

12-[3-(6-phenylpyren-1-yl)phenyl]-[1]benzofuro[2,3-a]carbazole
CID 176780527
12-[3-(6-naphthalen-1-ylpyren-1-yl)phenyl]-[1]benzofuro[2,3-a]carbazole
CID 176780567
12-(4-phenyldibenzofuran-2-yl)-[1]benzofuro[2,3-a]carbazole
CID 171612107
12-(4-dibenzofuran-4-ylphenyl)-2,11-diphenylindolo[2,3-a]carbazole
CID 126580151
12-[9-[3-(3-phenylphenyl)phenyl]dibenzofuran-3-yl]-[1]benzofuro[2,3-a]carbazole
CID 170277606
12-(3-dibenzofuran-4-yl-5-phenylphenyl)-[1]benzofuro[2,3-a]carbazole
CID 171612099
12-[6,10-bis([1]benzofuro[2,3-a]carbazol-12-yl)triphenylen-2-yl]-[1]benzofuro[2,3-a]carbazole
CID 122548582
11-phenyl-12-(6-phenyldibenzofuran-3-yl)indolo[2,3-a]carbazole
CID 122594951
12-[4-[4-(3-carbazol-9-ylphenyl)phenyl]phenyl]-[1]benzofuro[2,3-a]carbazole
CID 166510073
12-(4-dibenzofuran-4-ylphenyl)-11-phenylindolo[2,3-a]carbazole
CID 71098785
15-naphthalen-2-yl-3-oxa-15-azahexacyclo[11.11.0.02,10.04,9.014,22.016,21]tetracosa-1(13),2(10),4,6,8,11,14(22),16,18,20,23-undecaene
CID 118652925
12-[4-[2-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]-[1]benzofuro[2,3-a]carbazole
CID 129254550

Frequently Asked Questions

What is the IUPAC name of 12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole?
The IUPAC name of 12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole (CID 118502601) is 12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole.
What is the SMILES notation for 12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole?
The canonical SMILES for 12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole is c1ccc(-c2cccc3cc(-n4c5ccccc5c5ccc6c7ccccc7oc6c54)ccc23)cc1.
What is the InChIKey of 12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole?
The InChIKey is GDFFBICOTRTCQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H21NO/c1-2-9-22(10-3-1)25-14-8-11-23-21-24(17-18-26(23)25)35-31-15-6-4-12-27(31)29-19-20-30-28-13-5-7-16-32(28)36-34(30)33(29)35/h1-21H.
What are the key properties of 12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole?
12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole has a molecular weight of 459.55 g/mol, XLogP of 9.50, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 12-(5-phenylnaphthalen-2-yl)-[1]benzofuro[2,3-a]carbazole is sourced from PubChem (CID 118502601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).