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

C25H17NO — CID 123156036

IUPAC6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole
SMILESCc1c2oc3ccccc3c2cc2c3ccccc3n(-c3ccccc3)c12
InChIInChI=1S/C25H17NO/c1-16-24-20(15-21-19-12-6-8-14-23(19)27-25(16)21)18-11-5-7-13-22(18)26(24)17-9-3-2-4-10-17/h2-15H,1H3
InChIKeyIUNUTJVKMHPPCP-UHFFFAOYSA-N
MW347.42 g/mol
LogP6.99
Rot. Bonds1

About 6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole

6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole (PubChem CID 123156036) has the molecular formula C25H17NO and a molecular weight of 347.42 g/mol. Its IUPAC name is 6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole.

Molecular Properties

Compound Name6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole
PubChem CID123156036
Molecular FormulaC25H17NO
Molecular Weight347.42 g/mol
Exact Mass347.13
IUPAC Name6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole
SMILESCc1c2oc3ccccc3c2cc2c3ccccc3n(-c3ccccc3)c12
InChIInChI=1S/C25H17NO/c1-16-24-20(15-21-19-12-6-8-14-23(19)27-25(16)21)18-11-5-7-13-22(18)26(24)17-9-3-2-4-10-17/h2-15H,1H3
InChIKeyIUNUTJVKMHPPCP-UHFFFAOYSA-N
XLogP6.99
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 ≤ 56.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole?
The IUPAC name of 6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole (CID 123156036) is 6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole.
What is the SMILES notation for 6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole?
The canonical SMILES for 6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole is Cc1c2oc3ccccc3c2cc2c3ccccc3n(-c3ccccc3)c12.
What is the InChIKey of 6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole?
The InChIKey is IUNUTJVKMHPPCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17NO/c1-16-24-20(15-21-19-12-6-8-14-23(19)27-25(16)21)18-11-5-7-13-22(18)26(24)17-9-3-2-4-10-17/h2-15H,1H3.
What are the key properties of 6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole?
6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole has a molecular weight of 347.42 g/mol, XLogP of 6.99, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-7-phenyl-[1]benzofuro[2,3-b]carbazole is sourced from PubChem (CID 123156036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).