6-oxo-N-(3-phenoxyphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide

HCID 4875171

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 790705-40-7
Standard SMILES: O=C1CCC(C(=O)Nc2cccc(Oc3ccccc3)c2)=NN1
InChIKey: PCGPAGYPVQCMCF-UHFFFAOYSA-N
Molecular formula: C17H15N3O3
Average molar mass: 309.32 g/mol
Monoisotopic mass: 309.11134135

Names & identifiers

Preferred name: 6-oxo-N-(3-phenoxyphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide
IUPAC: 6-oxo-N-(3-phenoxyphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamide

Names & synonyms

6-oxo-N-(3-phenoxyphenyl)-4,5-dihydro-1H-pyridazine-3-carboxamideMLS000771395CHEMBL1562191DTXSID901331857HMS2725O09AKOS034142883790705-40-7SMR000344449Z307920126-oxo-N-(3-phenoxyphenyl)-1,4,5,6-tetrahydropyridazine-3-carboxamide

Database identifiers

CAS: 790705-40-7
PubChem CID: 4875171
DTXSID: DTXSID901331857
ChEMBL: CHEMBL1562191

Properties

Computed structural properties

XLogP: 1.7
Topological polar surface area: 79.8 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 4
Rotatable bonds: 4
Heavy atoms: 23
Formal charge: 0
Complexity: 472

Experimental & physicochemical properties

Solubility11.1 [ug/mL] (The mean of the results at pH 7.4)

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…