Basic information
- Standard SMILES
CN(Cc1oc2ccccc2c1Cl)C(=O)/C=C/c1cnc2c(c1)OCC(=O)N2- InChIKey
PUPHTZOSRKLTNQ-VOTSOKGWSA-N- Molecular formula
- C20H16ClN3O4
- Average molar mass
- 397.8 g/mol
Names & identifiers
- Preferred name
- (E)-N-((3-chlorobenzofuran-2-yl)methyl)-N-methyl-3-(3-oxo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazin-7-yl)acrylamide
- IUPAC
- (E)-N-[(3-chloro-1-benzofuran-2-yl)methyl]-N-methyl-3-(3-oxo-4H-pyrido[3,2-b][1,4]oxazin-7-yl)prop-2-enamide
Names & synonyms
SCHEMBL1254939PUPHTZOSRKLTNQ-VOTSOKGWSA-N(E)-N-((3-chlorobenzofuran-2-yl)methyl)-N-methyl-3-(3-oxo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazin-7-yl)acrylamide
Database identifiers
- PubChem CID
- 16660975
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 84.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 631
Related reactions
2 records
Compound notes
Loading…