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Montelukast 1,2-Diol(Mixture of Diastereomers) , CAS No.186352-97-6
Basic Description Synonyms 2-(1-((((1R)-1-(3-((E)-2-(7-Chloroquinolin-2-yl)vinyl)phenyl)-3-(2-(1,2-dihydroxypropan-2-yl)phenyl)propyl)thio)methyl)cyclopropyl)acetic acid | MONTELUKAST 1,2-DIOL | 1-((((1R)-1-(3-((1E)-2-(7-Chloro-2-quinolinyl)ethenyl)phenyl)-3-(2-(1,2-dihydroxy-1-met Storage Temp Store at -20°C Shipped In Ice chest + Ice pads Product Description Montelukast 1,2-Diol(Mixture of Diastereomers) is a monohydroxylated analog of the leukotriene LTD4 receptor antagonist Montelukast . The isopropyl group of Montelukast is hydroxylated at a terminal carbon to produce Montelukast 1,2-Diol, and this preparation is a mixture of the possible diastereomers of this compound. Montelukast 1,2-Diol is reported to be an antagonist of the LTD4 receptor similar to the parent compound.
Associated Targets(Human) Mechanisms of Action Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References
Names and Identifiers IUPAC Name 2-[1-[[(1R)-1-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]-3-[2-(1,2-dihydroxypropan-2-yl)phenyl]propyl]sulfanylmethyl]cyclopropyl]acetic acid INCHI InChI=1S/C35H36ClNO4S/c1-34(41,22-38)30-8-3-2-6-25(30)12-16-32(42-23-35(17-18-35)21-33(39)40)27-7-4-5-24(19-27)9-14-29-15-11-26-10-13-28(36)20-31(26)37-29/h2-11,13-15,19-20,32,38,41H,12,16-18,21-23H2,1H3,(H,39,40)/b14-9+/t32-,34?/m1/s1 InChi Key UFQIEVSCRCMNLW-SHISVWIYSA-N Canonical SMILES CC(CO)(C1=CC=CC=C1CCC(C2=CC=CC(=C2)C=CC3=NC4=C(C=CC(=C4)Cl)C=C3)SCC5(CC5)CC(=O)O)O Isomeric SMILES CC(CO)(C1=CC=CC=C1CC[C@H](C2=CC=CC(=C2)/C=C/C3=NC4=C(C=CC(=C4)Cl)C=C3)SCC5(CC5)CC(=O)O)O PubChem CID 9960377 Molecular Weight 602.18
Chemical and Physical Properties Solubility Soluble in acetone, and methanol. Melt Point(°C) 100-109° C
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