AC1LD8CV structure

AC1LD8CV

4-[(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)amino]-4-oxobutanoic acid

Also Known As: Oprea1_830076|4-((3-cyano-5-ethyl-5-methyl-5,7-dihydro-4H-thieno[2,3-c]pyran-2-yl)amino)-4-oxobutanoic acid|4-[(3-cyano-5-ethyl-5-methyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl)amino]-4-oxobutanoic acid|4-[(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)amino]-4-oxobutanoic acid

CAS: 375357-87-2
Molecular Formula C15H18N2O4S
Molecular Weight 322.09872 g/mol
LogP 1.7
Topological Polar Surface Area 128.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 5
Exact Mass 322.09872
Monoisotopic Mass 322.09872
Heavy Atoms 22
Complexity 503.0

Chemical Identifiers

CAS Number 375357-87-2
SMILES CCC1(CC2=C(CO1)SC(=C2C#N)NC(=O)CCC(=O)O)C
InChIKey FLHAQYLDRODBIJ-UHFFFAOYSA-N

Product Overview

AC1LD8CV (CAS 375357-87-2), with molecular formula C15H18N2O4S and molecular weight 322.09872 g/mol. IUPAC: 4-[(3-cyano-5-ethyl-5-methyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)amino]-4-oxobutanoic acid.

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