Basic information
- CAS
137215-12-4- Standard SMILES
Cc1cc(=O)oc2cc(O[C@@H]3SC[C@@H](O)[C@H](O)[C@H]3O)ccc12- InChIKey
JRHNIQQUVJOPQC-AQNFWKISSA-N- Molecular formula
- C15H16O6S
- Average molar mass
- 324.4 g/mol
- Monoisotopic mass
- 324.0667594
Overview
orally active beta-D-xyloside for the treatment of venous thrombosis in a rat model
Names & identifiers
- Preferred name
- Odiparcil
- IUPAC
- 4-methyl-7-[(2R,3R,4S,5S)-3,4,5-trihydroxythian-2-yl]oxychromen-2-one
- English name
- odiparcil
- Molecular formula
- C15H16O6S
- Molecular weight
- 324.35
Names & synonyms
Odiparcil137215-12-4odiparciloDTXSID4057639FIK1414ZI8DTXCID50314284-Methyl-7-(5-thio-beta-D-xylopyranosyloxy)-2H-chromen-2-oneODIPARCILUMRefChem:1679354-methyl-7-(((2R,3R,4S,5S)-3,4,5-trihydroxythian-2-yl)oxy)-2H-chromen-2-oneOdiparcil [INN]4-methyl-7-[(2R,3R,4S,5S)-3,4,5-trihydroxythian-2-yl]oxychromen-2-one
Show more names
Odiparcil - SB 424323 | GSK 4243232H-1-Benzopyran-2-one, 4-methyl-7-[(5-thio-β-D-xylopyranosyl)oxy]-
GSK 4243234-methyl-2-oxo-2H-1-benzopyran-7-yl 5-thio-beta-D-xylopyranosideSB-424323Odiparcil - SB 424323GSK-424323ODIPARCIL [WHO-DD]UNII-FIK1414ZI8SCHEMBL4515803
Database identifiers
- CAS
137215-12-4- PubChem CID
- 216385
- DTXSID
DTXSID4057639- ChEMBL
CHEMBL2107763- UNII
- FIK1414ZI8
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 467
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- Boiling point
- 567.4 · 567.4±50.0 °C(Predicted)
- Density
- 1.529 · 1.529±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- Soluble in DMSO
- form
- Solid
- pka
- 12.78 · 12.78±0.70(Predicted)
- color
- White to off-white
- FDA UNII
- 1414 ZI8 · FIK1414ZI8
Chemistry & industry
Applications
UsesOdiparcil (SB-424323) is an orally active beta-d-thioxyloside analog with antithrombotic activity associated with a reduced risk of adverse bleeding events. Odiparcil (SB-424323) is indirect thrombin inhibitor that exerts its anticoagulant effect through activation of antithrombin II (heparin cofactor II) [1][2].
Suppliers10 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
Aladdin Scientific[email protected]
銳迪國際科技有限公司18024082417 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
四川省维克奇生物科技有限公司028-81700200 18116577057 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海立崎生物医学研究中心18014399201 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
Related reactions
1 records
Compound notes
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