Compound: Metipranolol
SMILES: O=C(Oc1c(c(c(OCC(O)CNC(C)C)cc1C)C)C)C
InChIKey: BQIPXWYNLPYNHW-UHFFFAOYSA-N
Synonyms: Metipranolol, 22664-55-7, Trimepranol, Metipranololum, VUAB-6453, VUAB6453, DTXSID4046078, X39AL81KEB, (+-)-metipranolol, BM-01004, BM01.004, Phenol, 4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-2,3,6-trimethyl-, 1-acetate, Methypranol, 4-{2-hydroxy-3-[(propan-2-yl)amino]propoxy}-2,3,6-trimethylphenyl acetate, BM-01.004, CHEBI:6897, DTXCID2026078, Acetic acid 4-(2-hydroxy-3-isopropylamino-propoxy)-2,3,6-trimethyl-phenyl ester, Phenol, 4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]-2,3,6-trimethyl-, 1-acetate, metipranololo, Glauline, 4-(2-hydroxy-3-((propan-2-yl)amino)propoxy)-2,3,6-trimethylphenyl acetate, 1-(4-Acetoxy-2,3,5-Trimethylphenoxy)-3-Isopropylamino-2-Propanol, RefChem:925824, S01ED04, 245-151-5, Metipranololum [INN-Latin], D,l-metipranolol, Disorat, [4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2,3,6-trimethylphenyl] acetate, VUAB6453 (SPOFA), Turoptin, NCGC00159498-02, 4-(2-hydroxy-3-(isopropylamino)propoxy)-2,3,6-trimethylphenyl acetate, VUFB-6453, EINECS 245-151-5, Metipranolol (USAN/INN), UNII-X39AL81KEB, BRN 2152010, Metipranolol [USAN:INN:BAN], (RS)-4-(2-Hydroxy-3-isopropylaminopropoxy)-2,3,6-trimethylphenyl acetat, 1-(4-Hydroxy-2,3,5-trimethylphenoxy)-3-(isopropylamino)-2-propanol 4-acetate, 4-(2-Hydroxy-3-((1-methylethyl)-amino)propoxy)-2,3,6-trimethylphenol 1-acetate, (+-)-1-(4-Hydroxy-2,3,5-trimethylphenoxy)-3-(isopropylamino)-2-propanol 4-acetate, (+/-)-metipranolol, Metipranolol (Standard), GlyTouCan:G27369LA, METIPRANOLOL [MI], METIPRANOLOL [INN], METIPRANOLOL [USAN], 2-Propanol, 1-(4-hydroxy-2,3,5-trimethylphenoxy)-3-(isopropylamino)-, 4-acetate, CHEMBL1291, METIPRANOLOL [VANDF], SCHEMBL24324, METIPRANOLOL [MART.], METIPRANOLOL [WHO-DD], GTPL7239, orb1685343, SCHEMBL29962877, HMS5087K06, EX-A4499, G27369LA, Tox21_111719, EBC-26724, MFCD00864567, [4-[2-hydroxy-3-(isopropylamino)propoxy]-2,3,6-trimethyl-phenyl] acetate, AKOS015995599, DB01214, HY-121567R, Phenol, 4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-2,3,6-trimethyl-, (+-)-, 1-acetate, NCGC00159498-03, DA-75513, MS-24496, CAS-22664-55-7, HY-121567, CS-0082752, NS00004058, C07915, D02374, G12675, SBI-0654196.0001, EN300-18563025, L001291, SR-01000883679, Q6593346, SR-01000883679-1, BRD-A99388803-001-01-5, 1-(2,3,5-trimethyl-4-acetoxyphenoxy)-3-isopropylamino-2-propanol, 4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2,3,6-trimethylphenyl acetate, (+/-)-1-(4-HYDROXY-2,3,5-TRIMETHYLPHENOXY)-3-(ISOPROPYLAMINO)-2-PROPANOL 4-ACETATE, PHENOL, 4-(2-HYDROXY-3-((1-METHYLETHYL)AMINO)PROPOXY)-2,3,6-TRIMETHYL-, (+/-)-, 1-ACETATE
Theoretical properties:
molecular_formula: C17H27NO4
molecular_weight: 309.4 g/mol
exact_mass: 309.19400834 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 2
hydrogen_bond_acceptor_count: 5
rotatable_bond_count: 8
heavy_atom_count: 22
topological_polar_surface_area: 67.8 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
melting_point: 105-107 °C
Descriptions:
pubchem: Metipranolol is 3-(Propan-2-ylamino)propane-1,2-diol in which the hydrogen of the primary hydroxy group is substituted by a 4-acetoxy-2,3,5-trimethylphenoxy group. A non-cardioselective beta-blocker, it is used to lower intra-ocular pressure in the management of open-angle glaucoma. It has a role as a beta-adrenergic antagonist, an antihypertensive agent, an anti-arrhythmia drug and an antiglaucoma drug. It is a propanolamine, an aromatic ether, an acetate ester and a secondary amino compound.
chebi: 3-(Propan-2-ylamino)propane-1,2-diol in which the hydrogen of the primary hydroxy group is substituted by a 4-acetoxy-2,3,5-trimethylphenoxy group. A non-cardioselective beta-blocker, it is used to lower intra-ocular pressure in the management of open-angle glaucoma.
chembl: METIPRANOLOL is a small molecule listed in the ChEMBL database and has reached clinical trial phase 4.0.
wikipedia: Metipranolol (OptiPranolol, Betanol, Disorat, Trimepranol) is a non-selective beta blocker used in eye drops to treat glaucoma.  It is rapidly metabolized into desacetylmetipranolol.