Basic information
- CAS
89391-50-4- Standard SMILES
O=C1NC(=O)C2(N1)c1cc(F)ccc1-c1ccc(F)cc12- InChIKey
QCCHBHSAIQIQGO-UHFFFAOYSA-N- Molecular formula
- C15H8F2N2O2
- Average molar mass
- 286.23 g/mol
- Monoisotopic mass
- 286.05538383
Overview
Imirestat is a small molecule drug. The usage of the INN stem '-restat' in the name indicates that Imirestat is a aldose reductase inhibitor. Imirestat has a monoisotopic molecular weight of 286.06 Da.
Names & identifiers
- Preferred name
- Imirestat
- IUPAC
- 2,7-difluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione
- English name
- Imirestat
- Molecular formula
- C15H8F2N2O2
- Molecular weight
- 286.23
Names & synonyms
Imirestat89391-50-4Hoe-843HOE 843AL-1576Alcon 15762,7-difluorospiro[fluorene-9,4'-imidazolidine]-2',5'-dioneImirestatumAL 1576AL15760PM69S95UQ2,7-Difluorospiro(fluorene-9,4'-imidazolidine)-2',5'-dione
Show more names
Imirestat, 10 mM in DMSO2,7-Difluorospiro[fluorene-9,4’-imidazolidine]-2’,5’-dione2,7-Difluorospiro[9H-fluorene-9,4'-imidazolidine]-2',5'-dioneSpiro[9H-fluorene-9,4'-imidazolidine]-2',5'-dione, 2,7-difluoro-2,7-Difluoro-2'H,5'H-spiro[fluorene-9,4'-imidazolidine]-2',5'-dione
DTXSID80237635ALO1576RefChem:148022spiro(2,7-difluoro-9H-fluoren-9,4'-imidazolidine)-2',5'-dioneDTXCID30160126Imirestat [INN]MFCD00865639CHEMBL269455
Database identifiers
- CAS
89391-50-4- PubChem CID
- 65673
- DTXSID
DTXSID80237635- ChEMBL
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 472
Physicochemical properties
- Density
- 1.58 · 1.58±0.1 g/cm3(Predicted)
- solubility
- 10 mg/ml · DMSO: Soluble: =10 mg/ml
- pka
- 8.17 · 8.17±0.20(Predicted)
- form
- Solid
- color
- White to off-white
- FDA UNII
- 0 PM69S95UQ · 0PM69S95UQ
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesImirestat (AL 1576) is an aldose reductase inhibitor, used for the treatment of diabetes.
Suppliers22 total
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Aladdin Scientific[email protected]
銳迪國際科技有限公司18024082417 · [email protected]
北京博奥森生物技术有限公司400-901-9800 18611424007 · [email protected]
MedChemexpress LLC021-58955995 · [email protected]
上海贺康生物技术有限公司17721021104 18939837085 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
北京建强伟业科技有限公司（FUSION弗珍试剂品牌）0531-88924771 15614660963 · [email protected]
淄博航宇生物科技发展有限公司13053322091 13053322091 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…