4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide

C50H36Br2Cl2N4O4 — CID 159911240

IUPAC4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2c(-c3ccc(Br)cc3)cc(-c3ccc(Br)cc3)[nH]c2=O)cc1.Cc1ccc(NC(=O)c2c(-c3ccc(Cl)cc3)cc(-c3ccc(Cl)cc3)[nH]c2=O)cc1
InChIInChI=1S/C25H18Br2N2O2.C25H18Cl2N2O2/c2*1-15-2-12-20(13-3-15)28-24(30)23-21(16-4-8-18(26)9-5-16)14-22(29-25(23)31)17-6-10-19(27)11-7-17/h2*2-14H,1H3,(H,28,30)(H,29,31)
InChIKeyNXFATSVGIGHQTG-UHFFFAOYSA-N
MW987.58 g/mol
LogP13.37
Rot. Bonds8

About 4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide

4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 159911240) has the molecular formula C50H36Br2Cl2N4O4 and a molecular weight of 987.58 g/mol. Its IUPAC name is 4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID159911240
Molecular FormulaC50H36Br2Cl2N4O4
Molecular Weight987.58 g/mol
Exact Mass984.05
IUPAC Name4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2c(-c3ccc(Br)cc3)cc(-c3ccc(Br)cc3)[nH]c2=O)cc1.Cc1ccc(NC(=O)c2c(-c3ccc(Cl)cc3)cc(-c3ccc(Cl)cc3)[nH]c2=O)cc1
InChIInChI=1S/C25H18Br2N2O2.C25H18Cl2N2O2/c2*1-15-2-12-20(13-3-15)28-24(30)23-21(16-4-8-18(26)9-5-16)14-22(29-25(23)31)17-6-10-19(27)11-7-17/h2*2-14H,1H3,(H,28,30)(H,29,31)
InChIKeyNXFATSVGIGHQTG-UHFFFAOYSA-N
XLogP13.37
TPSA123.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500987.58
LogP ≤ 513.37
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze 4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide 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 4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide (CID 159911240) is 4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide is Cc1ccc(NC(=O)c2c(-c3ccc(Br)cc3)cc(-c3ccc(Br)cc3)[nH]c2=O)cc1.Cc1ccc(NC(=O)c2c(-c3ccc(Cl)cc3)cc(-c3ccc(Cl)cc3)[nH]c2=O)cc1.
What is the InChIKey of 4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is NXFATSVGIGHQTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18Br2N2O2.C25H18Cl2N2O2/c2*1-15-2-12-20(13-3-15)28-24(30)23-21(16-4-8-18(26)9-5-16)14-22(29-25(23)31)17-6-10-19(27)11-7-17/h2*2-14H,1H3,(H,28,30)(H,29,31).
What are the key properties of 4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 987.58 g/mol, XLogP of 13.37, 8 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-bis(4-bromophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide;4,6-bis(4-chlorophenyl)-N-(4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 159911240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).