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Bornaprine

CAT: 1596-AR-B01833-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-B01833-02Size:25 Units
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CAS Number
20448-86-6
Synonyms
3- (diethylamino) propyl 3-phenylbicyclo[2.2.1]heptane-3-carboxylate;2-Phenyl-2-norbornanecarboxylic acid 3-diethylaminopropyl ester;2-Phenyl-2-norbornanecarboxylic acid 3- (diethylamino) propyl ester;3- (Diethylamino) propyl 2-phenyl-2-norbornanecarboxylate;2-Phenylbicyclo[2.2.1]heptane-2-carboxylic acid 3- (diethylamino) propyl ester; BORNAPRINE HYDROCHLORIDE; BORNAPRINE; Bornaprin
Molecular Formula
C21H31NO2
Molecular Weight
329.49
API Name
Bornaprine

Chemical Information

Bornaprine

beneficial effect in Parkinsonism due to inhibition of muscarinic or nicotinic transmission

CAS Number20448-86-6
PubChem CID70687267
IUPAC Name3-(diethylamino)propyl (1S,4R)-2-phenylbicyclo[2.2.1]heptane-2-carboxylate
Molecular FormulaC21H31NO2
Molecular Weight329.5
XLogP4.7
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count9
Heavy Atom Count24
Formal Charge0
Complexity414
SMILES
CCN(CC)CCCOC(=O)C1(C[C@@H]2CC[C@H]1C2)C3=CC=CC=C3
InChI
InChI=1S/C21H31NO2/c1-3-22(4-2)13-8-14-24-20(23)21(18-9-6-5-7-10-18)16-17-11-12-19(21)15-17/h5-7,9-10,17,19H,3-4,8,11-16H2,1-2H3/t17-,19+,21?/m1/s1
InChIKey
BDNMABJZSXTKAQ-VCPDFFEISA-N
Chemical Structure
2D Structure
2D structure of Bornaprine
CAS: 20448-86-6
CID: 70687267
Formula: C21H31NO2
MW: 329.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight329.5
XLogP34.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count9
Exact Mass329.235479232
Monoisotopic Mass329.235479232
Topological Polar Surface Area29.5 Ų
Heavy Atom Count24
Formal Charge0
Complexity414
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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