2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine

C24H20ClNO — CID 2239413

IUPAC2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine
SMILESCc1ccc2oc(-c3ccc(Cl)cc3)c/c(=N\c3cccc(C)c3C)c2c1
InChIInChI=1S/C24H20ClNO/c1-15-7-12-23-20(13-15)22(26-21-6-4-5-16(2)17(21)3)14-24(27-23)18-8-10-19(25)11-9-18/h4-14H,1-3H3/b26-22+
InChIKeyLSUJHNNWSWODCE-XTCLZLMSSA-N
MW373.88 g/mol
LogP6.91
Rot. Bonds2

About 2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine

2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine (PubChem CID 2239413) has the molecular formula C24H20ClNO and a molecular weight of 373.88 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine
PubChem CID2239413
Molecular FormulaC24H20ClNO
Molecular Weight373.88 g/mol
Exact Mass373.12
IUPAC Name2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine
SMILESCc1ccc2oc(-c3ccc(Cl)cc3)c/c(=N\c3cccc(C)c3C)c2c1
InChIInChI=1S/C24H20ClNO/c1-15-7-12-23-20(13-15)22(26-21-6-4-5-16(2)17(21)3)14-24(27-23)18-8-10-19(25)11-9-18/h4-14H,1-3H3/b26-22+
InChIKeyLSUJHNNWSWODCE-XTCLZLMSSA-N
XLogP6.91
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.88
LogP ≤ 56.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine 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 2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine?
The IUPAC name of 2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine (CID 2239413) is 2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine.
What is the SMILES notation for 2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine?
The canonical SMILES for 2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine is Cc1ccc2oc(-c3ccc(Cl)cc3)c/c(=N\c3cccc(C)c3C)c2c1.
What is the InChIKey of 2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine?
The InChIKey is LSUJHNNWSWODCE-XTCLZLMSSA-N. The full InChI is InChI=1S/C24H20ClNO/c1-15-7-12-23-20(13-15)22(26-21-6-4-5-16(2)17(21)3)14-24(27-23)18-8-10-19(25)11-9-18/h4-14H,1-3H3/b26-22+.
What are the key properties of 2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine?
2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine has a molecular weight of 373.88 g/mol, XLogP of 6.91, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-6-methylchromen-4-imine is sourced from PubChem (CID 2239413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).