AC1Q5ULV structure

AC1Q5ULV

8,9-dimethoxy-2-(pyridin-3-ylmethylcarbamoyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-3-carboxylic acid

Also Known As: 5-22-09-00323 (Beilstein Handbook Reference)|Pyrrolo(2,1-a)isoquinoline-3-carboxylic acid, 5,6-dihydro-8,9-dimethoxy-2-(((3-pyridinylmethyl)amino)carbonyl)-|8,9-dimethoxy-2-[(pyridin-3-ylmethyl)carbamoyl]-5,6-dihydropyrrolo[2,1-a]isoquinoline-3-carboxylic acid|8,9-dimethoxy-2-(pyridin-3-ylmethylcarbamoyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-3-carboxylic acid|8,9-Dimethoxy-2-{[(pyridin-3-yl)methyl]carbamoyl}-5,6-dihydropyrrolo[2,1-a]isoquinoline-3-carboxylic acid

CAS: 54815-20-2
Molecular Formula C22H21N3O5
Molecular Weight 407.14813 g/mol
LogP 1.8
Topological Polar Surface Area 103.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 6
Exact Mass 407.14813
Monoisotopic Mass 407.14813
Heavy Atoms 30
Complexity 632.0

Chemical Identifiers

CAS Number 54815-20-2
SMILES COC1=C(C=C2C(=C1)CCN3C2=CC(=C3C(=O)O)C(=O)NCC4=CN=CC=C4)OC
InChIKey KJXQCYSYTCGFRB-UHFFFAOYSA-N

Product Overview

AC1Q5ULV (CAS 54815-20-2), with molecular formula C22H21N3O5 and molecular weight 407.14813 g/mol. IUPAC: 8,9-dimethoxy-2-(pyridin-3-ylmethylcarbamoyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-3-carboxylic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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