delta(sup 4)-1,2,4-Oxadiazoline, 5-(3-(diethylamino)propyl)-3-phenyl-, hydrochloride
Basic information
- CAS
102504-40-5- Standard SMILES
CC[NH+](CC)CCCC1=CN(c2ccccc2)NO1.[Cl-]- InChIKey
MYDGXUOXBHOOAM-UHFFFAOYSA-N- Molecular formula
- C15H24ClN3O
- Average molar mass
- 297.82 g/mol
- Monoisotopic mass
- 297.1607901
Names & identifiers
- Preferred name
- delta(sup 4)-1,2,4-Oxadiazoline, 5-(3-(diethylamino)propyl)-3-phenyl-, hydrochloride
- IUPAC
- diethyl-[3-(3-phenyl-2H-oxadiazol-5-yl)propyl]azanium chloride
Names & synonyms
delta(sup 4)-1,2,4-Oxadiazoline, 5-(3-(diethylamino)propyl)-3-phenyl-, hydrochloride102504-40-5RefChem:10831165-(3-(Diethylamino)propyl)-3-phenyl-delta(sup 4)-1,2,4-oxadiazoline hydrochloridediethyl-[3-(3-phenyl-2H-oxadiazol-5-yl)propyl]azanium;chloride
Database identifiers
- CAS
102504-40-5- PubChem CID
- 59414
Properties
Computed structural properties
- Topological polar surface area
- 28.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 283
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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