N,N'-(Naphthalene-1,5-diyl)bis(3-oxobutanamide)
Basic information
- CAS
54940-90-8- Standard SMILES
CC(=O)CC(=O)Nc1cccc2c(NC(=O)CC(C)=O)cccc12- InChIKey
HAWUSTKXUCKDRX-UHFFFAOYSA-N- Molecular formula
- C18H18N2O4
- Average molar mass
- 326.3 g/mol
- Monoisotopic mass
- 326.12665706
Names & identifiers
- Preferred name
- N,N'-(Naphthalene-1,5-diyl)bis(3-oxobutanamide)
- IUPAC
- 3-oxo-N-[5-(3-oxobutanoylamino)naphthalen-1-yl]butanamide
Names & synonyms
54940-90-8N,N'-(Naphthalene-1,5-diyl)bis(3-oxobutanamide)SCHEMBL11434479DTXSID60707260
Database identifiers
- CAS
54940-90-8- PubChem CID
- 53867652
- DTXSID
DTXSID60707260
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 471
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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