Basic information
- CAS
62367-94-6- Standard SMILES
C/C(=C/C(=O)c1c(-c2ccccc2)[nH]c2ccccc12)N1CCOCC1- InChIKey
KFTAKGDZIDBXCD-NXVVXOECSA-N- Molecular formula
- C22H22N2O2
- Average molar mass
- 346.4 g/mol
- Monoisotopic mass
- 346.16812795
Names & identifiers
- Preferred name
- 2-Buten-1-one, 3-(4-morpholinyl)-1-(2-phenyl-1H-indol-3-yl)-
- IUPAC
- (Z)-3-morpholin-4-yl-1-(2-phenyl-1H-indol-3-yl)but-2-en-1-one
Names & synonyms
2-Buten-1-one, 3-(4-morpholinyl)-1-(2-phenyl-1H-indol-3-yl)-62367-94-6RefChem:1062556BRN 47346423-(4-Morpholinyl)-1-(2-phenyl-1H-indol-3-yl)-2-buten-1-one
Database identifiers
- CAS
62367-94-6- PubChem CID
- 6446541
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 45.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 520
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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