7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole

C31H19N3O — CID 118502665

IUPAC7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-n2c(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)nc3ccccc32)cc1
InChIInChI=1S/C31H19N3O/c1-2-10-20(11-3-1)33-27-16-8-6-14-25(27)32-31(33)34-26-15-7-4-12-21(26)23-18-24-22-13-5-9-17-29(22)35-30(24)19-28(23)34/h1-19H
InChIKeyGIOKQZDLZDPUBW-UHFFFAOYSA-N
MW449.51 g/mol
LogP8.02
Rot. Bonds2

About 7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole

7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole (PubChem CID 118502665) has the molecular formula C31H19N3O and a molecular weight of 449.51 g/mol. Its IUPAC name is 7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole.

Molecular Properties

Compound Name7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole
PubChem CID118502665
Molecular FormulaC31H19N3O
Molecular Weight449.51 g/mol
Exact Mass449.15
IUPAC Name7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole
SMILESc1ccc(-n2c(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)nc3ccccc32)cc1
InChIInChI=1S/C31H19N3O/c1-2-10-20(11-3-1)33-27-16-8-6-14-25(27)32-31(33)34-26-15-7-4-12-21(26)23-18-24-22-13-5-9-17-29(22)35-30(24)19-28(23)34/h1-19H
InChIKeyGIOKQZDLZDPUBW-UHFFFAOYSA-N
XLogP8.02
TPSA35.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500449.51
LogP ≤ 58.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

11-phenyl-[1]benzofuro[3,2-b]carbazole
CID 102324620
15-phenyl-19-(4-phenylquinazolin-2-yl)-11-oxa-15,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene
CID 129142011
19-(4,6-diphenyl-1,3,5-triazin-2-yl)-15-phenyl-11-oxa-15,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene
CID 140957360
2-(4-dibenzofuran-2-yl-6-phenyl-1,3,5-triazin-2-yl)-7-phenyl-[1]benzofuro[2,3-b]carbazole
CID 163733499
25-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-15-phenyl-11-oxa-15,25-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17,19,21,23,26-dodecaene
CID 140957385
3-[4-dibenzofuran-3-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-7-phenyl-[1]benzofuro[2,3-b]carbazole
CID 163958673
15-phenyl-11-(4-phenylquinazolin-2-yl)-25-oxa-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17,19,21,23,26-dodecaene
CID 129141891
7-(4,6-diphenyl-1,3,5-triazin-2-yl)-[1]benzofuro[2,3-b]carbazole;7-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[2,3-b]carbazole
CID 160917779
7-phenyl-10-[4-(7-phenyl-[1]benzofuro[2,3-b]carbazol-10-yl)phenyl]-[1]benzofuro[2,3-b]carbazole
CID 134223336
7-[4-[3,6-bis(9-phenylcarbazol-3-yl)carbazol-9-yl]-6-chloro-1,3,5-triazin-2-yl]-[1]benzofuro[2,3-b]carbazole
CID 126632893
9-(4-dibenzofuran-2-ylphenyl)-3-[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazole
CID 118149535
7-(4,6-diphenylpyrimidin-2-yl)-[1]benzofuro[2,3-b]carbazole
CID 70851639

Frequently Asked Questions

What is the IUPAC name of 7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole?
The IUPAC name of 7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole (CID 118502665) is 7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole.
What is the SMILES notation for 7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole?
The canonical SMILES for 7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole is c1ccc(-n2c(-n3c4ccccc4c4cc5c(cc43)oc3ccccc35)nc3ccccc32)cc1.
What is the InChIKey of 7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole?
The InChIKey is GIOKQZDLZDPUBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H19N3O/c1-2-10-20(11-3-1)33-27-16-8-6-14-25(27)32-31(33)34-26-15-7-4-12-21(26)23-18-24-22-13-5-9-17-29(22)35-30(24)19-28(23)34/h1-19H.
What are the key properties of 7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole?
7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole has a molecular weight of 449.51 g/mol, XLogP of 8.02, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1-phenylbenzimidazol-2-yl)-[1]benzofuro[2,3-b]carbazole is sourced from PubChem (CID 118502665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).