11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole

C25H17NO — CID 169027784

IUPAC11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole
SMILESCn1c2cc3c(cc2c2c(-c4ccccc4)cccc21)oc1ccccc13
InChIInChI=1S/C25H17NO/c1-26-21-12-7-11-17(16-8-3-2-4-9-16)25(21)20-15-24-19(14-22(20)26)18-10-5-6-13-23(18)27-24/h2-15H,1H3
InChIKeyDHUKTXMWAOVIBY-UHFFFAOYSA-N
MW347.42 g/mol
LogP6.90
Rot. Bonds1

About 11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole

11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole (PubChem CID 169027784) has the molecular formula C25H17NO and a molecular weight of 347.42 g/mol. Its IUPAC name is 11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole.

Molecular Properties

Compound Name11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole
PubChem CID169027784
Molecular FormulaC25H17NO
Molecular Weight347.42 g/mol
Exact Mass347.13
IUPAC Name11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole
SMILESCn1c2cc3c(cc2c2c(-c4ccccc4)cccc21)oc1ccccc13
InChIInChI=1S/C25H17NO/c1-26-21-12-7-11-17(16-8-3-2-4-9-16)25(21)20-15-24-19(14-22(20)26)18-10-5-6-13-23(18)27-24/h2-15H,1H3
InChIKeyDHUKTXMWAOVIBY-UHFFFAOYSA-N
XLogP6.90
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.42
LogP ≤ 56.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole?
The IUPAC name of 11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole (CID 169027784) is 11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole.
What is the SMILES notation for 11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole?
The canonical SMILES for 11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole is Cn1c2cc3c(cc2c2c(-c4ccccc4)cccc21)oc1ccccc13.
What is the InChIKey of 11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole?
The InChIKey is DHUKTXMWAOVIBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17NO/c1-26-21-12-7-11-17(16-8-3-2-4-9-16)25(21)20-15-24-19(14-22(20)26)18-10-5-6-13-23(18)27-24/h2-15H,1H3.
What are the key properties of 11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole?
11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole has a molecular weight of 347.42 g/mol, XLogP of 6.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyl-7-phenyl-[1]benzofuro[3,2-b]carbazole is sourced from PubChem (CID 169027784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).