Basic information
- CAS
118248-91-2- Standard SMILES
Cc1ncc(COP(=O)(O)O)c(CN(CCN(CC(=O)O)Cc2c(COP(=O)(O)O)cnc(C)c2O)CC(=O)O)c1O- InChIKey
SQKUFYLUXROIFM-UHFFFAOYSA-N- Molecular formula
- C22H32N4O14P2
- Average molar mass
- 638.5 g/mol
- Monoisotopic mass
- 638.1390257
Names & identifiers
- Preferred name
- Fodipir
- IUPAC
- 2-[2-[carboxymethyl-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]methyl]amino]ethyl-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]methyl]amino]acetic acid
- English name
- Fodipir
- Molecular formula
- C22H32N4O14P2
- Molecular weight
- 638.457
Names & synonyms
FODIPIR118248-91-2DPDPP28BIW0UTB2-[2-[carboxymethyl-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methyl]amino]ethyl-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl]methyl]amino]acetic acidGlycine, N,N'-1,2-ethanediylbis(N-((3-hydroxy-2-methyl-5-((phosphonooxy)methyl)-4-pyridinyl)methyl)-Fodipir [USAN]Fodipir [USAN:INN]UNII-P28BIW0UTBC22H32N4O14P2Fodipir (USAN/INN)FODIPIR [INN]
Show more names
Glycine, N,N'-1,2-ethanediylbis[N-[[3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]-4-pyridinyl]methyl]-
orb1706187SCHEMBL1004581CHEMBL1208640DTXSID1043960SCHEMBL29363302TEA24891MFCD00868476NSC766818
Database identifiers
- CAS
118248-91-2- PubChem CID
- 60683
Properties
Computed structural properties
- XLogP
- -8.1
- Topological polar surface area
- 281 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 18
- Rotatable bonds
- 17
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 907
Physicochemical properties
- Boiling point
- 1049.1 · 1049.1±75.0 °C(Predicted)
- Density
- 1.657 · 1.657±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- Soluble in DMSO
- form
- Solid
- pka
- 1.57 · 1.57±0.10(Predicted)
- color
- Light yellow to yellow
- FDA UNII
- 28 BIW0UTB · P28BIW0UTB
- 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
UsesExcipient.
UsesFodipir is a research reagent which along with dephosphorylated derivative Dipyridoxyl Ethyldiamine are involved in Mangafodipir-mediated cytoprotection against 7β-Hydroxycholesterol-Induced cell death.
Suppliers12 total
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
Aladdin Scientific[email protected]
欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
上海喀露蓝科技有限公司18149758185 18149758185 · [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]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
ChemeGen 中国18818260767 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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