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Levobetaxolol Hydrochloride

CAT: 1596-AR-B07046-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-B07046-01Size:10 Units
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CAS Number
116209-55-3
Molecular Formula
C18H29NO3. HCl
Molecular Weight
307.43 36.46
API Name
Betaxolol

Chemical Information

Levobetaxolol Hydrochloride

Levobetaxolol Hydrochloride is the hydrochloride salt form of levobetaxolol, the S-isomer of the -selective beta-1 adrenergic receptor antagonist betaxolol with anti-glaucoma activity and devoid of intrinsic sympathomimetic activity. When applied topically in the eye, levobetaxolol reduces aqueous humor secretion and lowers the intraocular pressure (IOP).

CAS Number116209-55-3
PubChem CID60656
IUPAC Name(2S)-1-[4-[2-(cyclopropylmethoxy)ethyl]phenoxy]-3-(propan-2-ylamino)propan-2-ol;hydrochloride
Molecular FormulaC18H30ClNO3
Molecular Weight343.9
Topological Polar Surface Area50.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count11
Heavy Atom Count23
Formal Charge0
Complexity286
SMILES
CC(C)NC[C@@H](COC1=CC=C(C=C1)CCOCC2CC2)O.Cl
InChI
InChI=1S/C18H29NO3.ClH/c1-14(2)19-11-17(20)13-22-18-7-5-15(6-8-18)9-10-21-12-16-3-4-16;/h5-8,14,16-17,19-20H,3-4,9-13H2,1-2H3;1H/t17-;/m0./s1
InChIKey
CHDPSNLJFOQTRK-LMOVPXPDSA-N
Chemical Structure
2D Structure
2D structure of Levobetaxolol Hydrochloride
CAS: 116209-55-3
CID: 60656
Formula: C18H30ClNO3
MW: 343.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight343.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count11
Exact Mass343.1914215
Monoisotopic Mass343.1914215
Topological Polar Surface Area50.7 Ų
Heavy Atom Count23
Formal Charge0
Complexity286
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes