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2D Structure
Also known as: 20448-86-6, 3-(diethylamino)propyl 2-phenylbicyclo[2.2.1]heptane-2-carboxylate, Bornaprine (inn), 3-(diethylamino)propyl 2-phenyl-2-norbornanecarboxylate, Schembl924755, Chembl4297087
Molecular Formula
C21H31NO2
Molecular Weight
329.5  g/mol
InChI Key
BDNMABJZSXTKAQ-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3-(diethylamino)propyl 2-phenylbicyclo[2.2.1]heptane-2-carboxylate
2.1.2 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
2.1.3 InChI Key
BDNMABJZSXTKAQ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CCN(CC)CCCOC(=O)C1(CC2CCC1C2)C3=CC=CC=C3
2.2 Synonyms
2.2.1 MeSH Synonyms

1. Bornaprine Hydrochloride

2. Kr 339

3. Sormodren

2.2.2 Depositor-Supplied Synonyms

1. 20448-86-6

2. 3-(diethylamino)propyl 2-phenylbicyclo[2.2.1]heptane-2-carboxylate

3. Bornaprine (inn)

4. 3-(diethylamino)propyl 2-phenyl-2-norbornanecarboxylate

5. Schembl924755

6. Chembl4297087

7. Dtxsid20864944

8. Chebi:135406

9. D07302

10. Q4946040

2.3 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 329.5 g/mol
Molecular Formula C21H31NO2
XLogP34.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count9
Exact Mass329.235479232 g/mol
Monoisotopic Mass329.235479232 g/mol
Topological Polar Surface Area29.5 Ų
Heavy Atom Count24
Formal Charge0
Complexity414
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count3
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Muscarinic Antagonists

Drugs that bind to but do not activate MUSCARINIC RECEPTORS, thereby blocking the actions of endogenous ACETYLCHOLINE or exogenous agonists. Muscarinic antagonists have widespread effects including actions on the iris and ciliary muscle of the eye, the heart and blood vessels, secretions of the respiratory tract, GI system, and salivary glands, GI motility, urinary bladder tone, and the central nervous system. (See all compounds classified as Muscarinic Antagonists.)


4.2 ATC Code

N - Nervous system

N04 - Anti-parkinson drugs

N04A - Anticholinergic agents

N04AA - Tertiary amines

N04AA11 - Bornaprine