(E)-N-(3-Chloro-benzofuran-2-ylmethyl)-3-(2,2-dimethyl-3-oxo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazin-7-yl)-N-methyl-acrylamide

HCID 16660818
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Basic information

Standard SMILES
CN(Cc1oc2ccccc2c1Cl)C(=O)/C=C/c1cnc2c(c1)OC(C)(C)C(=O)N2
InChIKey
AKKDFFNCAASLEF-CMDGGOBGSA-N
Molecular formula
C22H20ClN3O4
Average molar mass
425.9 g/mol
Monoisotopic mass
425.1142338

Names & identifiers

Preferred name
(E)-N-(3-Chloro-benzofuran-2-ylmethyl)-3-(2,2-dimethyl-3-oxo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazin-7-yl)-N-methyl-acrylamide
IUPAC
(E)-N-[(3-chloro-1-benzofuran-2-yl)methyl]-3-(2,2-dimethyl-3-oxo-4H-pyrido[3,2-b][1,4]oxazin-7-yl)-N-methylprop-2-enamide

Names & synonyms

SCHEMBL1254439AKKDFFNCAASLEF-CMDGGOBGSA-N(E)-N-(3-Chloro-benzofuran-2-ylmethyl)-3-(2,2-dimethyl-3-oxo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazin-7-yl)-N-methyl-acrylamide

Database identifiers

PubChem CID
16660818

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
84.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
30

Related reactions

2 records
New reaction record

Compound notes

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