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Opipramol

CAT: 0926-FO26574-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0926-FO26574-02Size:25 mg
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CAS Number
315-72-0
Synonyms
4-[3- (5H-Dibenz[b, f]azepin-5-yl) propyl]-1-piperazineethanol; N-[3-[4- (2-Hydroxyethyl) piperazino]propyl]iminostilbene
MDL Number
MFCD00865455
Smiles
C1CN (CCN1CCCN2C3=CC=CC=C3C=CC4=CC=CC=C42) CCO
Molecular Formula
C23H29N3O
Molecular Weight
363.5 g/mol
Controlled
No

Chemical Information

Opipramol

2-[4-[3-(11-benzo[b][1]benzazepinyl)propyl]-1-piperazinyl]ethanol is a dibenzoazepine.

CAS Number315-72-0
PubChem CID9417
IUPAC Name2-[4-(3-benzo[b][1]benzazepin-11-ylpropyl)piperazin-1-yl]ethanol
Molecular FormulaC23H29N3O
Molecular Weight363.5
XLogP3.6
Topological Polar Surface Area30
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count27
Formal Charge0
Complexity448
SMILES
C1CN(CCN1CCCN2C3=CC=CC=C3C=CC4=CC=CC=C42)CCO
InChI
InChI=1S/C23H29N3O/c27-19-18-25-16-14-24(15-17-25)12-5-13-26-22-8-3-1-6-20(22)10-11-21-7-2-4-9-23(21)26/h1-4,6-11,27H,5,12-19H2
InChIKey
YNZFUWZUGRBMHL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Opipramol
CAS: 315-72-0
CID: 9417
Formula: C23H29N3O
MW: 363.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight363.5
XLogP33.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass363.231062557
Monoisotopic Mass363.231062557
Topological Polar Surface Area30 Ų
Heavy Atom Count27
Formal Charge0
Complexity448
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes