Compound Summary
Oxybutynin chloride
Compound Information
Oxybutynin chloride
Compound Name: | Oxybutynin chloride |
Compound CID: | 91505 |
Synonyms: | Oxybutynin chloride Oxybutynin hydrochloride 1508-65-2 Oxybutynin HCl Oxybutynin (chloride) More... |
Iupac Name: | 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate;hydrochloride |
InChI: | InChI=1S/C22H31NO3.ClH/c1-3-23(4-2)17-11-12-18-26-21(24)22(25,19-13-7-5-8-14-19)20-15-9-6-10-16-20;/h5,7-8,13-14,20,25H,3-4,6,9-10,15-18H2,1-2H3;1H |
InChIKey: | SWIJYDAEGSIQPZ-UHFFFAOYSA-N |
Canonical Smiles: | CCN(CC)CC#CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O.Cl |
Isomeric Smiles: | CCN(CC)CC#CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O.Cl |
Molecular Weight: | 393.9 |
Molecular Formula: | C22H32ClNO3 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Oxybutynin chloride
Molecular Weight: | 393.9 |
Molecular Formula: | C22H32ClNO3 |
Hydrogen Bond Donor Count: | 2 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 8 |
Heavy Atom Count: | 27 |
Complexity: | 490 |
Synonyms
Oxybutynin chloride
| Oxybutynin chloride | Oxybutynin chloride |
|---|---|
Oxybutynin chloride |
Oxybutynin hydrochloride |
1508-65-2 |
Oxybutynin HCl |
Oxybutynin (chloride) |
Ditropan Xl |
MJ 4309-1 |
C22H32ClNO3 |
alpha-Phenylcyclohexaneglycolic acid 4-(diethylamino)-2-butynyl ester hydrochloride |
MLS000069688 |
MFCD00072150 |
Dridase |
SMR000058490 |
Tropax |
4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate hydrochloride |
4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate;hydrochloride |
4-Diethylamino-2-butynyl phenyl(cyclohexyl)glycolate hydrochloride |
4-(Diethylamino)-2-butynyl alpha-phenylcyclohexaneglycolate hydrochloride |
Gelnique |
Oxibutinina hydrochloride |
CHEBI:7857 |
4-Diethylaminobut-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylethanoate Hydrochloride |
SR-01000000184 |
EINECS 216-139-7 |
4-(Diethylamino)but-2-ynyl cyclohexylphenylglycolate hydrochloride |
Oxybutynin chloride USAN:USP |
Ditropan (TN) |
Gelnique (TN) |
Prestwick_621 |
Oxybutynin-d11 HCl |
1173019-04-9 |
4-(diethylamino)but-2-yn-1-yl cyclohexyl(hydroxy)phenylacetate hydrochloride |
Opera_ID_1330 |
NCGC00016583-01 |
Oxybutynin (hydrochloride) |
Oxybutynin chloride (USP) |
CAS-1508-65-2 |
CHEMBL1133 |
DSSTox_CID_25356 |
DSSTox_RID_80822 |
DSSTox_GSID_45356 |
SCHEMBL25751 |
MLS001148211 |
MLS002222232 |
REGID_for_CID_91505 |
Oxybutynin hydrochloride (JAN) |
DTXSID3045356 |
HY-B0267A |
(S)-4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate hydrochloride |
HMS1568J16 |
Pharmakon1600-01505399 |
(R,S) - Oxybutynin Hydrochloride |
BCP12138 |
Oxybutynin chloride-(phenyl-d5) |
Tox21_110507 |
Tox21_500923 |
NSC759108 |
s3117 |
4-(Diethylamino)-2-butynyl (+-)-alpha-phenylcyclohexaneglycolate hydrochloride |
AKOS015895349 |
CCG-213420 |
H33O205 |
KS-1377 |
LP00923 |
MCULE-5193326065 |
NC00580 |
NSC 759108 |
NSC-759108 |
VA11467 |
Cyclohexaneglycolic acid, alpha-phenyl-, 4-(diethylamino)-2-butynyl ester, hydrochloride |
NCGC00094234-01 |
NCGC00094234-02 |
NCGC00261608-01 |
Benzeneacetic acid, alpha-cyclohexyl-alpha-hydroxy-, 4-(diethylamino)-2-butynyl ester hydrochloride |
Benzeneacetic acid, alpha-cyclohexyl-alpha-hydroxy-, 4-(diethylamino)-2-butynyl ester hydrochloride, (+-)- |
BO166187 |
H815 |
MJ-4309-1 |
EU-0100923 |
FT-0603563 |
FT-0673411 |
FT-0673412 |
Oxybutynin chloride, >=98% (TLC), powder |
ST51015085 |
SW196787-4 |
A51042 |
D00722 |
J10411 |
O 2881 |
A809082 |
J-008750 |
SR-01000000184-2 |
SR-01000000184-7 |
Q27107600 |
Oxybutynin chloride, meets EP, USP testing specifications |
4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate, chloride |
Oxybutynin chloride, United States Pharmacopeia (USP) Reference Standard |
Oxybutynin hydrochloride, British Pharmacopoeia (BP) Reference Standard |
Oxybutynin hydrochloride, European Pharmacopoeia (EP) Reference Standard |
2-CYCLOHEXYL-2-HYDROXY-2-PHENYLACETIC ACID 4-(DIETHYLAMINO)BUT-2-YNYL ESTER HCL |
4-(diethylamino)but-2-yn-1-yl 2-cyclohexyl-2-hydroxy-2-phenylacetate hydrochloride |
4-diethylamino-2-butynylphenyl(cyclohexyl)glycolatehydrochloride;Oxybutynin HCl |
Experimental Data
Oxybutynin chloride
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33.000000000000000 | umol/L | 5.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
Oxybutynin chloride
Statistics Data
Oxybutynin chloride
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 5.000000000000000 | 1 | 1 |
Statistics Data Visualization
Oxybutynin chloride
