5-Acetyl-2-ethyl-4-[(5-nitropyridin-2-yl)amino]-6-phenylpyridazin-3(2H)-one

HCID 68485652
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Basic information

Standard SMILES
CCn1nc(-c2ccccc2)c(C(C)=O)c(Nc2ccc([N+](=O)[O-])cn2)c1=O
InChIKey
PJAIRIJBTISMMG-UHFFFAOYSA-N
Molecular formula
C19H17N5O4
Average molar mass
379.4 g/mol
Monoisotopic mass
379.12805404

Names & identifiers

Preferred name
5-Acetyl-2-ethyl-4-[(5-nitropyridin-2-yl)amino]-6-phenylpyridazin-3(2H)-one
IUPAC
5-acetyl-2-ethyl-4-[(5-nitro-2-pyridinyl)amino]-6-phenylpyridazin-3-one

Names & synonyms

SCHEMBL3028422PJAIRIJBTISMMG-UHFFFAOYSA-N5-Acetyl-2-ethyl-4-[(5-nitropyridin-2-yl)amino]-6-phenylpyridazin-3(2H)-one

Database identifiers

PubChem CID
68485652

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
120 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
28

Related reactions

2 records
New reaction record

Linked notes

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