Basic information
- CAS
5998-93-6- Standard SMILES
CN(C)C(=O)N1CCC2(CC1)C(=O)N(CC(=O)NCCc1ccc(Cl)cc1Cl)CN2c1ccccc1- InChIKey
LYUSLHWBWYIRRA-UHFFFAOYSA-N- Molecular formula
- C26H31Cl2N5O3
- Average molar mass
- 532.5 g/mol
- Monoisotopic mass
- 531.1803953
Names & identifiers
- Preferred name
- 3-[2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl]-N,N-dimethyl-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decane-8-carboxamide
- IUPAC
- 3-[2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl]-N,N-dimethyl-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decane-8-carboxamide
Names & synonyms
5998-93-63-[2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl]-N,N-dimethyl-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decane-8-carboxamide3-(2-{[2-(2,4-Dichlorophenyl)ethyl]amino}-2-oxoethyl)-N,N-dimethyl-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decane-8-carboxamideAGN-PC-0LOQTWDTXSID30411241AKOS025163483
Database identifiers
- CAS
5998-93-6- PubChem CID
- 5223548
- DTXSID
DTXSID30411241
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 76.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 798
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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