Basic information
- CAS
796858-56-5- Standard SMILES
CC(NC(=O)CN1C(=O)NC2(CCCC2)C1=O)c1ccc(Cl)cc1Cl- InChIKey
XUCFVHPIWULEOW-UHFFFAOYSA-N- Molecular formula
- C17H19Cl2N3O3
- Average molar mass
- 384.3 g/mol
- Monoisotopic mass
- 383.0803469
Names & identifiers
- Preferred name
- N-[1-(2,4-dichlorophenyl)ethyl]-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)acetamide
- IUPAC
- N-[1-(2,4-dichlorophenyl)ethyl]-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)acetamide
Names & synonyms
MLS002249869CHEMBL1711990DTXSID101323965HMS3095C05AKOS033491620N-[1-(2,4-dichlorophenyl)ethyl]-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)acetamide796858-56-5SMR001317291Z16396136
Database identifiers
- CAS
796858-56-5- PubChem CID
- 4880191
- DTXSID
DTXSID101323965- ChEMBL
CHEMBL1711990
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 78.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 565
Experimental & physicochemical properties
Solubility51.8 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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