2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole

C23H22N4O — CID 134270701

IUPAC2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole
SMILESCc1ncc(-c2ccc3c(c2)COc2cc(-c4cnc(C(C)C)[nH]4)ccc2-3)[nH]1
InChIInChI=1S/C23H22N4O/c1-13(2)23-25-11-21(27-23)16-5-7-19-18-6-4-15(20-10-24-14(3)26-20)8-17(18)12-28-22(19)9-16/h4-11,13H,12H2,1-3H3,(H,24,26)(H,25,27)
InChIKeyWVGKTCOXKJEXOA-UHFFFAOYSA-N
MW370.46 g/mol
LogP5.46
Rot. Bonds3

About 2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole

2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole (PubChem CID 134270701) has the molecular formula C23H22N4O and a molecular weight of 370.46 g/mol. Its IUPAC name is 2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole.

Molecular Properties

Compound Name2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole
PubChem CID134270701
Molecular FormulaC23H22N4O
Molecular Weight370.46 g/mol
Exact Mass370.18
IUPAC Name2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole
SMILESCc1ncc(-c2ccc3c(c2)COc2cc(-c4cnc(C(C)C)[nH]4)ccc2-3)[nH]1
InChIInChI=1S/C23H22N4O/c1-13(2)23-25-11-21(27-23)16-5-7-19-18-6-4-15(20-10-24-14(3)26-20)8-17(18)12-28-22(19)9-16/h4-11,13H,12H2,1-3H3,(H,24,26)(H,25,27)
InChIKeyWVGKTCOXKJEXOA-UHFFFAOYSA-N
XLogP5.46
TPSA66.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.46
LogP ≤ 55.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole 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-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole?
The IUPAC name of 2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole (CID 134270701) is 2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole.
What is the SMILES notation for 2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole?
The canonical SMILES for 2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole is Cc1ncc(-c2ccc3c(c2)COc2cc(-c4cnc(C(C)C)[nH]4)ccc2-3)[nH]1.
What is the InChIKey of 2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole?
The InChIKey is WVGKTCOXKJEXOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O/c1-13(2)23-25-11-21(27-23)16-5-7-19-18-6-4-15(20-10-24-14(3)26-20)8-17(18)12-28-22(19)9-16/h4-11,13H,12H2,1-3H3,(H,24,26)(H,25,27).
What are the key properties of 2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole?
2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole has a molecular weight of 370.46 g/mol, XLogP of 5.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[3-(2-propan-2-yl-1H-imidazol-5-yl)-6H-benzo[c]chromen-8-yl]-1H-imidazole is sourced from PubChem (CID 134270701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).