7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole

C25H17NO — CID 169027641

IUPAC7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole
SMILESCn1c2cc3oc4ccccc4c3cc2c2cccc(-c3ccccc3)c21
InChIInChI=1S/C25H17NO/c1-26-22-15-24-21(18-10-5-6-13-23(18)27-24)14-20(22)19-12-7-11-17(25(19)26)16-8-3-2-4-9-16/h2-15H,1H3
InChIKeyMMPWSOAVMOMGEV-UHFFFAOYSA-N
MW347.42 g/mol
LogP6.90
Rot. Bonds1

About 7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole

7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole (PubChem CID 169027641) has the molecular formula C25H17NO and a molecular weight of 347.42 g/mol. Its IUPAC name is 7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole.

Molecular Properties

Compound Name7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole
PubChem CID169027641
Molecular FormulaC25H17NO
Molecular Weight347.42 g/mol
Exact Mass347.13
IUPAC Name7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole
SMILESCn1c2cc3oc4ccccc4c3cc2c2cccc(-c3ccccc3)c21
InChIInChI=1S/C25H17NO/c1-26-22-15-24-21(18-10-5-6-13-23(18)27-24)14-20(22)19-12-7-11-17(25(19)26)16-8-3-2-4-9-16/h2-15H,1H3
InChIKeyMMPWSOAVMOMGEV-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 7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole?
The IUPAC name of 7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole (CID 169027641) is 7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole.
What is the SMILES notation for 7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole?
The canonical SMILES for 7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole is Cn1c2cc3oc4ccccc4c3cc2c2cccc(-c3ccccc3)c21.
What is the InChIKey of 7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole?
The InChIKey is MMPWSOAVMOMGEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17NO/c1-26-22-15-24-21(18-10-5-6-13-23(18)27-24)14-20(22)19-12-7-11-17(25(19)26)16-8-3-2-4-9-16/h2-15H,1H3.
What are the key properties of 7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole?
7-methyl-8-phenyl-[1]benzofuro[2,3-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 7-methyl-8-phenyl-[1]benzofuro[2,3-b]carbazole is sourced from PubChem (CID 169027641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).