Basic information
- CAS
54340-59-9- Standard SMILES
CCOCC1COc2c(cc3[nH]cc(C(=O)OCC)c(=O)c3c2Cl)O1- InChIKey
AZOPNLGKZVSIIQ-UHFFFAOYSA-N- Molecular formula
- C17H18ClNO6
- Average molar mass
- 367.8 g/mol
- Monoisotopic mass
- 367.082265
Overview
Quincarbate is a dioxinoquinolone-based diuretic and chemically distinct from the thiazide diuretics. Quincarbate was never marketed.
Names & identifiers
- Preferred name
- Quincarbate
- IUPAC
- ethyl 10-chloro-3-(ethoxymethyl)-9-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinoline-8-carboxylate
- English name
- Quincarbate
- Molecular formula
- C17H18ClNO6
- Molecular weight
- 367.78
Names & synonyms
Quincarbate54340-59-9QuincarbatoQuincarbate [INN]DU-23187ethyl 10-chloro-3-(ethoxymethyl)-9-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinoline-8-carboxylateNSC-287475U40Q9GE876NSC287475Ethyl 10-chloro-3-(ethoxymethyl)-2,3,6,9-tetrahydro-9-oxo-p-dioxino(2,3-g)quinoline-8-carboxylateQuincarbatumUNII-U40Q9GE876
Show more names
10-Chloro-3-(ethoxymethyl)-2,3,6,9-tetrahydro-9-oxo-1,4-dioxino[2,3-g]quinoline-8-carboxylic acid ethyl ester1,4-Dioxino[2,3-g]quinoline-8-carboxylic acid, 10-chloro-3-(ethoxymethyl)-2,3,6,9-tetrahydro-9-oxo-, ethyl ester
NSC 287475Oprea1_638919orb2815219CHEMBL2104710SCHEMBL29387133DTXSID201023897ECA34059Ethyl 10-chlor-3-(ethoxymethyl)-2,3,6,9-tetrahydro-9-oxo-(1,4)dioxino(2,3-g)chinolin-8-ylcarboxylat
Database identifiers
- CAS
54340-59-9- PubChem CID
- 323967
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 553
Physicochemical properties
- FDA UNII
- 40 Q9GE876 · U40Q9GE876
Chemistry & industry
Applications
UsesQuincarbate is a diuretics.
Suppliers2 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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