5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran

C23H15ClO2 — CID 102287044

IUPAC5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran
SMILESCOc1ccc(-c2c(Cl)c3ccccc3c3oc4ccccc4c23)cc1
InChIInChI=1S/C23H15ClO2/c1-25-15-12-10-14(11-13-15)20-21-18-8-4-5-9-19(18)26-23(21)17-7-3-2-6-16(17)22(20)24/h2-13H,1H3
InChIKeyHOXFXWKPJPQYSP-UHFFFAOYSA-N
MW358.82 g/mol
LogP7.07
Rot. Bonds2

About 5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran

5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran (PubChem CID 102287044) has the molecular formula C23H15ClO2 and a molecular weight of 358.82 g/mol. Its IUPAC name is 5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran.

Molecular Properties

Compound Name5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran
PubChem CID102287044
Molecular FormulaC23H15ClO2
Molecular Weight358.82 g/mol
Exact Mass358.08
IUPAC Name5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran
SMILESCOc1ccc(-c2c(Cl)c3ccccc3c3oc4ccccc4c23)cc1
InChIInChI=1S/C23H15ClO2/c1-25-15-12-10-14(11-13-15)20-21-18-8-4-5-9-19(18)26-23(21)17-7-3-2-6-16(17)22(20)24/h2-13H,1H3
InChIKeyHOXFXWKPJPQYSP-UHFFFAOYSA-N
XLogP7.07
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.82
LogP ≤ 57.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran?
The IUPAC name of 5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran (CID 102287044) is 5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran.
What is the SMILES notation for 5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran?
The canonical SMILES for 5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran is COc1ccc(-c2c(Cl)c3ccccc3c3oc4ccccc4c23)cc1.
What is the InChIKey of 5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran?
The InChIKey is HOXFXWKPJPQYSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15ClO2/c1-25-15-12-10-14(11-13-15)20-21-18-8-4-5-9-19(18)26-23(21)17-7-3-2-6-16(17)22(20)24/h2-13H,1H3.
What are the key properties of 5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran?
5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran has a molecular weight of 358.82 g/mol, XLogP of 7.07, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(4-methoxyphenyl)naphtho[1,2-b][1]benzofuran is sourced from PubChem (CID 102287044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).