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Ot-730

CAT: 0013-GTR19219630-04Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19219630-04Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Ot-730 (QLT 091568) is a selective beta-blocker prodrug designed for ocular disease research. It is utilized in both in vitro and in vivo experimental models to investigate mechanisms and potential therapeutic applications for conditions such as glaucoma and ocular hypertension.
CAS Number
870809-51-1
Product Name Alternative
Ot-730, QLT091568, QLT-091568, QLT 091568
Field of Research
Metabolism Research
Purity
99.36% (May vary between batches)
Smiles
C (O[C@@H] (CNC (CNC (=O) C1CCOC1) (C) C) COC (=O) C2=C (C) C=C (O) C (O) =C2) (=O) C3 (C) CC3
Molecular Formula
C25H36N2O8
Molecular Weight
492.56
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

OT-730

OT-730 is under investigation in clinical trial NCT00753168 (Phase 1-2 Evaluation of OT-730 Eye Drops in Reducing the Intraocular Pressure in Patients With Ocular Hypertension or Open-angle Glaucoma).

CAS Number870809-51-1
PubChem CID11554979
IUPAC Name[(2S)-2-(1-methylcyclopropanecarbonyl)oxy-3-[[2-methyl-1-(oxolane-3-carbonylamino)propan-2-yl]amino]propyl] 4,5-dihydroxy-2-methylbenzoate
Molecular FormulaC25H36N2O8
Molecular Weight492.6
XLogP1.7
Topological Polar Surface Area143
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count13
Heavy Atom Count35
Formal Charge0
Complexity769
SMILES
CC1=CC(=C(C=C1C(=O)OC[C@H](CNC(C)(C)CNC(=O)C2CCOC2)OC(=O)C3(CC3)C)O)O
InChI
InChI=1S/C25H36N2O8/c1-15-9-19(28)20(29)10-18(15)22(31)34-13-17(35-23(32)25(4)6-7-25)11-27-24(2,3)14-26-21(30)16-5-8-33-12-16/h9-10,16-17,27-29H,5-8,11-14H2,1-4H3,(H,26,30)/t16?,17-/m0/s1
InChIKey
ANXXSWNMHQHOQC-DJNXLDHESA-N
Chemical Structure
2D Structure
2D structure of OT-730
CAS: 870809-51-1
CID: 11554979
Formula: C25H36N2O8
MW: 492.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight492.6
XLogP31.7
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count13
Exact Mass492.24716611
Monoisotopic Mass492.24716611
Topological Polar Surface Area143 Ų
Heavy Atom Count35
Formal Charge0
Complexity769
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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