Basic information
- Standard SMILES
CN(Cc1oc2ccccc2c1Cl)C(=O)/C=C/c1cnc2c(c1)CCC(=O)N2- InChIKey
MUKICZYXYOTMHT-RMKNXTFCSA-N- Molecular formula
- C21H18ClN3O3
- Average molar mass
- 395.8 g/mol
Names & identifiers
- Preferred name
- (E)-N-(3-Chloro-benzofuran-2-ylmethyl)-N-methyl-3-(7-oxo-5,6,7,8-tetrahydro-[1,8]naphthyridin-3-yl)-acrylamide
- IUPAC
- (E)-N-[(3-chloro-1-benzofuran-2-yl)methyl]-N-methyl-3-(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-3-yl)prop-2-enamide
Names & synonyms
SCHEMBL1254600MUKICZYXYOTMHT-RMKNXTFCSA-N(E)-N-(3-Chloro-benzofuran-2-ylmethyl)-N-methyl-3-(7-oxo-5,6,7,8-tetrahydro-[1,8]naphthyridin-3-yl)-acrylamide(E)-N-(3-Chloro-benzofuran-2-ylmethyl)-N-methyl-3-(7-oxo-5,6,7,8-tetrahydro-[1.8]naphthyridin-3-yl)-acrylamide
Database identifiers
- PubChem CID
- 16660479
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 628
Related reactions
2 records
Compound notes
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