Compound: Bambuterol
SMILES: O=C(Oc1cc(OC(=O)N(C)C)cc(c1)C(O)CNC(C)(C)C)N(C)C
InChIKey: ANZXOIAKUNOVQU-UHFFFAOYSA-N
Synonyms: Bambuterol, 81732-65-2, Bambuterolum, Y1850G1OVC, [3-[2-(tert-butylamino)-1-hydroxyethyl]-5-(dimethylcarbamoyloxy)phenyl] N,N-dimethylcarbamate, CHEBI:553827, (+-)-5-(2-(tert-Butylamino)-1-hydroxyethyl)-m-phenylene bis(dimethylcarbamate), DTXSID5048550, (3-(2-(tert-butylamino)-1-hydroxyethyl)-5-(dimethylcarbamoyloxy)phenyl) N,N-dimethylcarbamate, RefChem:116411, 5-(2-(tert-butylamino)-1-hydroxyethyl)-3-phenylene bis(dimethylcarbamate), DTXCID1028106, R03CC12, 3-(2-(tert-butylamino)-1-hydroxyethyl)-5-((dimethylcarbamoyl)oxy)phenyl N,N-dimethylcarbamate, Bambuterol (INN), Bambuterolum [Latin], Oxeol, BAMBUTEROL [INN], 5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diyl bis(dimethylcarbamate), (+/-)-Bambuterol;KWD-2183, (+/-)-5-(2-(tert-butylamino)-1-hydroxyethyl)-m-phenylene bis(dimethylcarbamate), terbutaline bisdimethylcarbamate, Bambuterol [INN:BAN], UNII-Y1850G1OVC, 5-(2-(tert-butylamino)-1-hydroxyethyl)-1,3-phenylene bis(dimethylcarbamate), 5-[2-(tert-Butylamino)-1-hydroxyethyl]-1,3-phenylene bis(dimethylcarbamate), terbutaline bis(dimethylcarbamate), BAMBUTEROL [MI], Terbutaline Impurity 93, Prestwick0_000361, Prestwick1_000361, Prestwick2_000361, Prestwick3_000361, SCHEMBL4431, BAMBUTEROL [WHO-DD], BSPBio_000481, MLS002153785, ()-Bambuterol;KWD-2183, SPBio_002402, BPBio1_000531, CHEMBL521589, GTPL6601, orb1704664, ANZXOIAKUNOVQU-UHFFFAOYSA-N, GLXC-25236, HMS2089J18, HMS2230O15, HMS3373N13, BDBM50235800, STK643808, AKOS005574764, CS-3157, DB01408, NCGC00179546-01, NCGC00179546-02, AC-35438, HY-17501, SMR001233168, SBI-0207028.P001, NS00003068, D07377, H20704, L004435, Q3633651, SR-05000001470-1, BRD-A17462676-003-03-3, BRD-A17462676-003-06-6, BRD-A17462676-003-11-6, (RS)-5-[2-(tert-butylamino)-1-hydroxyethyl]benzene-1,3-diyl bis(dimethylcarbamate)
Theoretical properties:
molecular_formula: C18H29N3O5
molecular_weight: 367.4 g/mol
exact_mass: 367.21072103 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 2
hydrogen_bond_acceptor_count: 6
rotatable_bond_count: 8
heavy_atom_count: 26
topological_polar_surface_area: 91.3 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
solubility: 4.69e-01 g/L
Descriptions:
pubchem: Bambuterol is a carbamate ester that is terbutaline in which both of the phenolic hydroxy groups have been protected as the corresponding N,N-dimethylcarbamates. A long acting beta-adrenoceptor agonist used in the treatment of asthma, it is a prodrug for terbutaline. It has a role as a beta-adrenergic agonist, a bronchodilator agent, a sympathomimetic agent, an EC 3.1.1.7 (acetylcholinesterase) inhibitor, an anti-asthmatic drug, a prodrug and a tocolytic agent. It is a carbamate ester and a member of phenylethanolamines. It is functionally related to a terbutaline.
chebi: A carbamate ester that is terbutaline in which both of the phenolic hydroxy groups have been protected as the corresponding <em>N</em>,<em>N</em>-dimethylcarbamates. A long acting beta-adrenoceptor agonist used in the treatment of asthma, it is a prodrug for terbutaline.
chembl: BAMBUTEROL is a small molecule listed in the ChEMBL database and has reached clinical trial phase 3.0.
wikipedia: Bambuterol (INN) is a long-acting β adrenoceptor agonist (LABA) used in the treatment of asthma; it also is a prodrug of terbutaline. Commercially, the AstraZeneca pharmaceutical company produces and markets bambuterol as Bambec and Oxeol.
It is not available in the U.S.