6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide

C24H18F3N3O2 — CID 23358754

IUPAC6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide
SMILESO=C1CC(c2ccccc2)C(c2ccccc2)=NN1C(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C24H18F3N3O2/c25-24(26,27)18-11-13-19(14-12-18)28-23(32)30-21(31)15-20(16-7-3-1-4-8-16)22(29-30)17-9-5-2-6-10-17/h1-14,20H,15H2,(H,28,32)
InChIKeyPAEZKEMOGMGLFS-UHFFFAOYSA-N
MW437.42 g/mol
LogP5.66
Rot. Bonds3

About 6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide

6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide (PubChem CID 23358754) has the molecular formula C24H18F3N3O2 and a molecular weight of 437.42 g/mol. Its IUPAC name is 6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide.

Molecular Properties

Compound Name6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide
PubChem CID23358754
Molecular FormulaC24H18F3N3O2
Molecular Weight437.42 g/mol
Exact Mass437.14
IUPAC Name6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide
SMILESO=C1CC(c2ccccc2)C(c2ccccc2)=NN1C(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C24H18F3N3O2/c25-24(26,27)18-11-13-19(14-12-18)28-23(32)30-21(31)15-20(16-7-3-1-4-8-16)22(29-30)17-9-5-2-6-10-17/h1-14,20H,15H2,(H,28,32)
InChIKeyPAEZKEMOGMGLFS-UHFFFAOYSA-N
XLogP5.66
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.42
LogP ≤ 55.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-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 6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide?
The IUPAC name of 6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide (CID 23358754) is 6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide.
What is the SMILES notation for 6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide?
The canonical SMILES for 6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide is O=C1CC(c2ccccc2)C(c2ccccc2)=NN1C(=O)Nc1ccc(C(F)(F)F)cc1.
What is the InChIKey of 6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide?
The InChIKey is PAEZKEMOGMGLFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18F3N3O2/c25-24(26,27)18-11-13-19(14-12-18)28-23(32)30-21(31)15-20(16-7-3-1-4-8-16)22(29-30)17-9-5-2-6-10-17/h1-14,20H,15H2,(H,28,32).
What are the key properties of 6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide?
6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide has a molecular weight of 437.42 g/mol, XLogP of 5.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-3,4-diphenyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydropyridazine-1-carboxamide is sourced from PubChem (CID 23358754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).