Levobetaxolol hcl

C₁₈H₃₀ClNO₃CAS 116209-55-3343.89 g/mol

Open in Covalent MOL file

Alcohol Ether Secondary amine

Properties

Molecular formula: C₁₈H₃₀ClNO₃
Molar mass: 343.89 g/mol
Exact mass: 343.1914 Da
logP: 2.82Crippen estimate
Polar surface area: 50.7 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 11
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

116209-55-3

SMILES

CC(C)NC[C@@H](COC1=CC=C(C=C1)CCOCC2CC2)O.Cl

InChIKey

CHDPSNLJFOQTRK-LMOVPXPDSA-N

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

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Names and synonyms

1 names

Levobetaxolol hydrochloride

Work with Levobetaxolol hcl

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Betaxolol63659-18-793 % similar Metoprolol37350-58-667 % similar Esmolol hydrochloride81161-17-362 % similar Bisoprolol66722-44-959 % similar Esmolol81147-92-456 % similar Metoprolol succinate98418-47-456 % similar Atenolol29122-68-756 % similar Metoprolol tartrate56392-17-755 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Betaxolol hydrochloride63659-19-8

Elsewhere

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