Basic information
- CAS
64097-24-1- Standard SMILES
CCCCN(CCCC)CC(=O)Nc1ccc(C2NC(=O)C(C)(C)c3ccccc32)cc1- InChIKey
ACOUIJHLOAHEOI-UHFFFAOYSA-N- Molecular formula
- C27H37N3O2
- Average molar mass
- 435.6 g/mol
- Monoisotopic mass
- 435.28857743
Names & identifiers
- Preferred name
- Acetamide, 2-(dibutylamino)-N-(4-(1,2,3,4-tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl)-
- IUPAC
- 2-(dibutylamino)-N-[4-(4,4-dimethyl-3-oxo-1,2-dihydroisoquinolin-1-yl)phenyl]acetamide
Names & synonyms
BRN 04582202-(Dibutylamino)-N-(4-(1,2,3,4-tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl)acetamide64097-24-1Acetamide, 2-(dibutylamino)-N-(4-(1,2,3,4-tetrahydro-4,4-dimethyl-3-oxo-1-isoquinolinyl)phenyl)-RefChem:314496CHEMBL3277853DTXSID10982606N~2~,N~2~-Dibutyl-N-[4-(3-hydroxy-4,4-dimethyl-1,4-dihydroisoquinolin-1-yl)phenyl]glycinamide
Database identifiers
- CAS
64097-24-1- PubChem CID
- 3048895
- DTXSID
DTXSID10982606- ChEMBL
CHEMBL3277853
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 604
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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