2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole

C32H20N2O — CID 166134224

IUPAC2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole
SMILESc1ccc(-c2ccc3c([nH]c4ccccc43)c2-c2cc3ccc4oc5ccccc5c4c3[nH]2)cc1
InChIInChI=1S/C32H20N2O/c1-2-8-19(9-3-1)21-15-16-23-22-10-4-6-12-25(22)33-32(23)29(21)26-18-20-14-17-28-30(31(20)34-26)24-11-5-7-13-27(24)35-28/h1-18,33-34H
InChIKeyDSYJZYYTSGPMDL-UHFFFAOYSA-N
MW448.53 g/mol
LogP9.04
Rot. Bonds2

About 2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole

2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole (PubChem CID 166134224) has the molecular formula C32H20N2O and a molecular weight of 448.53 g/mol. Its IUPAC name is 2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole.

Molecular Properties

Compound Name2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole
PubChem CID166134224
Molecular FormulaC32H20N2O
Molecular Weight448.53 g/mol
Exact Mass448.16
IUPAC Name2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole
SMILESc1ccc(-c2ccc3c([nH]c4ccccc43)c2-c2cc3ccc4oc5ccccc5c4c3[nH]2)cc1
InChIInChI=1S/C32H20N2O/c1-2-8-19(9-3-1)21-15-16-23-22-10-4-6-12-25(22)33-32(23)29(21)26-18-20-14-17-28-30(31(20)34-26)24-11-5-7-13-27(24)35-28/h1-18,33-34H
InChIKeyDSYJZYYTSGPMDL-UHFFFAOYSA-N
XLogP9.04
TPSA44.72 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms35
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.53
LogP ≤ 59.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole?
The IUPAC name of 2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole (CID 166134224) is 2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole.
What is the SMILES notation for 2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole?
The canonical SMILES for 2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole is c1ccc(-c2ccc3c([nH]c4ccccc43)c2-c2cc3ccc4oc5ccccc5c4c3[nH]2)cc1.
What is the InChIKey of 2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole?
The InChIKey is DSYJZYYTSGPMDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H20N2O/c1-2-8-19(9-3-1)21-15-16-23-22-10-4-6-12-25(22)33-32(23)29(21)26-18-20-14-17-28-30(31(20)34-26)24-11-5-7-13-27(24)35-28/h1-18,33-34H.
What are the key properties of 2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole?
2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole has a molecular weight of 448.53 g/mol, XLogP of 9.04, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenyl-9H-carbazol-1-yl)-1H-[1]benzofuro[2,3-g]indole is sourced from PubChem (CID 166134224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).