Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C19H25NO2.ClH |
| Molecular Weight | 335.868 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CN(C)CC#CCCC(=O)C(O)(C1CCC1)C2=CC=CC=C2
InChI
InChIKey=HHNDPXLYTJTZSC-UHFFFAOYSA-N
InChI=1S/C19H25NO2.ClH/c1-20(2)15-8-4-7-14-18(21)19(22,17-12-9-13-17)16-10-5-3-6-11-16;/h3,5-6,10-11,17,22H,7,9,12-15H2,1-2H3;1H
| Molecular Formula | C19H25NO2 |
| Molecular Weight | 299.4073 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
PubMed
| Title | Date | PubMed |
|---|---|---|
| Analogues of oxybutynin. Synthesis and antimuscarinic and bladder activity of some substituted 7-amino-1-hydroxy-5-heptyn-2-ones and related compounds. | 1991 Oct |
|
| Determination of MDL 201,012 at femtomole/millilitre levels in human plasma by liquid chromatography with electrochemical detection. | 1992 Nov-Dec |
Patents
Sample Use Guides
In acute dose tolerance studies MDL 201012 was administered to humans as an oral solution in a dose of 4 mg.
Route of Administration:
Oral
Antimuscarinic activity was measured using strips of guinea pig bladder tetrusor muscle. Isometric contractions were recorded as a response for agonist stimulation. Antimuscarinic studies were conducted by constructing concentration-response curves to carbachol in the absence and presence of several concentrations of antagonist. MDL 201012 inhibits carbachol-induced contraction of bladder strips with Ki of 4.9 nM.
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 13:56:22 GMT 2023
by
admin
on
Sat Dec 16 13:56:22 GMT 2023
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| Record UNII |
ENI4D82I4W
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| Record Status |
Validated (UNII)
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| Record Version |
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PARENT -> SALT/SOLVATE |
