Ranirestat
(3R)-2'-[(4-bromo-2-fluorophenyl)methyl]spiro[pyrrolidine-3,4'-pyrrolo[1,2-a]pyrazine]-1',2,3',5-tetrone
Molecular Identity
Ranirestat
(3R)-2'-[(4-bromo-2-fluorophenyl)methyl]spiro[pyrrolidine-3,4'-pyrrolo[1,2-a]pyrazine]-1',2,3',5-tetrone
PubChem CID: 153948
Ranirestat is an organic molecular entity. It has a role as an EC 1.1.1.21 (aldehyde reductase) inhibitor.
2D Structure
Properties
C17H11BrFN3O4
Molecular Formula
420.20
Molecular Weight
g/mol
418.9917
Exact Mass
Da
1.3
XLogP
Drug-like (Lipinski: < 5)
88.5
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
689
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Ranirestat147254-64-6AS-3201Z26P56GFTVSX-3030SX 3201DTXSID80163642SX-3202(3R)-2'-(4-Bromo-2-fluorobenzyl)spiro(pyrrolidine-3,4'(1'H)-pyrrolo(1,2-a)pyrazine)-1',2,3',5(2'H)-tetroneranirestatumRefChem:875121DTXCID0086133Spiro(pyrrolidine-3,4'(1'H)-pyrrolo(1,2-a)pyrazine)-1',2,3',5(2'H)-tetrone, 2'-((4-bromo-2-fluorophenyl)methyl)-, (3R)-(3R)-2'-((4-bromo-2-fluorophenyl)methyl)-2',3'-dihydro-1'H-spiro(pyrrolidine-3,4'-pyrrolo(1,2-a)pyrazine)-1',2,3',5-tetrone110-113-8
Data from PubChem (NCBI)
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Drug Network
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