N-[3-[2-(dimethylamino)ethoxy]-4-propan-2-ylphenyl]-4-[2-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide;oxalic acid
Basic information
- CAS
170230-97-4- Standard SMILES
Cc1nc(-c2ccc(-c3ccc(C(=O)Nc4ccc(C(C)C)c(OCCN(C)C)c4)cc3)c(C)c2)no1.O=C(O)C(=O)O- InChIKey
WCFHMIIAGXSZHX-UHFFFAOYSA-N- Molecular formula
- C32H36N4O7
- Average molar mass
- 588.6 g/mol
- Monoisotopic mass
- 588.2583995
Names & identifiers
- Preferred name
- N-[3-[2-(dimethylamino)ethoxy]-4-propan-2-ylphenyl]-4-[2-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide;oxalic acid
- IUPAC
- N-[3-[2-(dimethylamino)ethoxy]-4-propan-2-ylphenyl]-4-[2-methyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide;oxalic acid
Names & synonyms
TCMDC-138990CHEMBL546764
Database identifiers
- CAS
170230-97-4- PubChem CID
- 44533087
- ChEMBL
CHEMBL546764
Properties
Computed structural properties
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 10
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 782
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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