AC1L4IQX structure

AC1L4IQX

[(4aS,8S,8aS)-2-acetamido-8a-acetyl-6-methyl-4-oxo-3,4a,5,8-tetrahydroquinazolin-8-yl] acetate

Also Known As: [(4aS,8S,8aS)-2-acetamido-8a-acetyl-6-methyl-4-oxo-3,4a,5,8-tetrahydroquinazolin-8-yl] Acetate|Acetamide, N-(8a-acetyl-8-(acetyloxy)-1,4,4a,5,8,8a-hexahydro-6-methyl-4-oxo-2-quinazolinyl)-, cis-|Carbamic acid,(5,6-diamino-4-hydroxy-2-pyridinyl)-,ethyl ester|(4AS,8S,8aS)-2-acetamido-8a-acetyl-6-methyl-4-oxo-1,4,4a,5,8,8a-hexahydroquinazolin-8-yl acetate|(4AS,8S,8aS)-2-acetamido-8a-acetyl-6-methyl-4-oxo-1,4,4a,5,8,8a-hexahydroquinazolin-8-ylacetate|(4aS,8S,8aS)-8a-acetyl-2-(acetylamino)-6-methyl-4-oxo-3,4,4a,5,8,8a-hexahydroquinazolin-8-yl acetate|(4aS,8S,8aS)-8a-acetyl-2-acetamido-6-methyl-4-oxo-1,4,4a,5,8,8a-hexahydroquinazolin-8-yl acetate|N-[(4aS,8S,8aS)-8a-Acetyl-8-(acetyloxy)-4-hydroxy-6-methyl-4a,5,8,8a-tetrahydroquinazolin-2-yl]ethanimidic acid|N-[8a-Acetyl-8-(acetyloxy)-4-hydroxy-6-methyl-4a,5,8,8a-tetrahydroquinazolin-2-yl]ethanimidic acid

CAS: 86970-99-2
Molecular Formula C15H19N3O5
Molecular Weight 321.13248 g/mol
LogP -1.1
Topological Polar Surface Area 114.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 4
Exact Mass 321.13248
Monoisotopic Mass 321.13248
Heavy Atoms 23
Complexity 651.0

Chemical Identifiers

CAS Number 86970-99-2
SMILES CC1=C[C@@H]([C@@]2([C@H](C1)C(=O)NC(=N2)NC(=O)C)C(=O)C)OC(=O)C
InChIKey QFLNFLJYEDWRAV-XUJVJEKNSA-N

Product Overview

AC1L4IQX (CAS 86970-99-2), with molecular formula C15H19N3O5 and molecular weight 321.13248 g/mol. IUPAC: [(4aS,8S,8aS)-2-acetamido-8a-acetyl-6-methyl-4-oxo-3,4a,5,8-tetrahydroquinazolin-8-yl] acetate.

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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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