Basic information
- CAS
83014-44-2- Standard SMILES
COc1cc(N(CC(=O)O)CC(=O)O)c2nc(COc3cc(C)ccc3N(CC(=O)O)CC(=O)O)ccc2c1- InChIKey
XCBWMEWFFNUFLV-UHFFFAOYSA-N- Molecular formula
- C26H27N3O10
- Average molar mass
- 541.5 g/mol
- Monoisotopic mass
- 541.16964407
Overview
See also: Quin2 (annotation moved to).
Names & identifiers
- Preferred name
- Glycine, N-(2-((8-(bis(carboxymethyl)amino)-6-methoxy-2-quinolinyl)methoxy)-4-methylphenyl)-N-(carboxymethyl)-
- IUPAC
- 2-[2-[[8-[bis(carboxymethyl)amino]-6-methoxyquinolin-2-yl]methoxy]-N-(carboxymethyl)-4-methylanilino]acetic acid
- English name
- QUIN 2
- Molecular formula
- C26H27N3O10
- Molecular weight
- 541.51
Names & synonyms
83014-44-2Quin II2-[2-[[8-[bis(carboxymethyl)amino]-6-methoxyquinolin-2-yl]methoxy]-N-(carboxymethyl)-4-methylanilino]acetic acidGlycine, N-(2-((8-(bis(carboxymethyl)amino)-6-methoxy-2-quinolinyl)methoxy)-4-methylphenyl)-N-(carboxymethyl)-QUIN2 FREE ACIDP6R8CW67YDSCHEMBL26379QUIN2 FREE ACID [MI]orb2939538DTXSID401003065TYD-01062HY-W127794
Show more names
QUIN 2Quin-2, free acidQUETIAPINEFUMARATE2-[(2-Amino-5-methylphenoxy)methyl]-6-methoxy-8-aminoquinoline-N,N,N',N'-tetraaceticacid2-[(2-BIS-[CARBOXYMETHYL]AMINO-5-METHYLPHENOXY)METHYL]-6-METHOXY-8-BIS[CARBOXYMETHYL]AMINOQUINOLINEGlycine, N-[2-[[8-[bis(carboxymethyl)amino]-6-methoxy-2-quinolinyl]methoxy]-4-methylphenyl]-N-(carboxymethyl)- (9CI)
N-(2-((8-(Bis(carboxymethyl)amino)-6-methoxy-2-quinolinyl)methoxy)-4-methylphenyl)-N-(carboxymethyl)glycineCS-01859642,2'-{[2-({2-[Bis(carboxymethyl)amino]-5-methylphenoxy}methyl)-6-methoxyquinolin-8-yl]azanediyl}diacetic acid2-[2-[[8-[bis(carboxymethyl)amino]-6-methoxyquinolin-2-yl]methoxy]-N-(carboxymethyl)-4-methylanilino]aceticacidN-(2-((8-(BIS(CARBOXYMETHYL)AMINO)-6-METHOXY-2-QUINOLINYL)METHOXY)-4-METHYLPHENYL)-N-(CARBOXYMETHYL) GLYCINE
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 187 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 14
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 841
Physicochemical properties
- FDA UNII
- 448 IDK23O · O448IDK23O
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H335
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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
- H319-H315-H335
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Applications
UsesQuin II is a fluorescent Ca2+ indicator compound. Quin II is a quinoline-based compound that is described to function as an indicator of intracellular Ca2+ concentration and to also serve as a buffer of intracellular Ca2+ levels.
Suppliers2 total
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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