AC1LDNK3 structure

AC1LDNK3

6-amino-3-(methoxymethyl)spiro[2H-pyrano[2,3-c]pyrazole-4,4'-thiane]-5-carbonitrile

Also Known As: AM-807/14144016|SR-01000283026-1|6-amino-3-(methoxymethyl)-5-spiro[2H-pyrano[2,3-c]pyrazole-4,4'-thiane]carbonitrile|6-amino-3-(methoxymethyl)spiro[2H-pyrano[2,3-c]pyrazole-4,4'-thiane]-5-carbonitrile|A3496/0148227|6-amino-3-(methoxymethyl)-2',3',5',6'-tetrahydro-2H-spiro[pyrano[2,3-c]pyrazole-4,4'-thiopyran]-5-carbonitrile|6-amino-3-(methoxymethyl)spiro[4H-pyrano[2,3-c]pyrazole-4,4'-thiane]-5-carboni trile|6-amino-5-cyano-3-(methoxymethyl)-2,3',4,4',5',6'-hexahydrospiro[pyrano[2,3-c]pyrazole-4,4'-(2'H)-thiopyran]

CAS: 330645-48-2
Molecular Formula C13H16N4O2S
Molecular Weight 292.0994 g/mol
LogP 1.1
Topological Polar Surface Area 122.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 2
Exact Mass 292.0994
Monoisotopic Mass 292.0994
Heavy Atoms 20
Complexity 466.0

Chemical Identifiers

CAS Number 330645-48-2
SMILES COCC1=C2C(=NN1)OC(=C(C23CCSCC3)C#N)N
InChIKey WNXWUQRVNFZHIJ-UHFFFAOYSA-N

Product Overview

AC1LDNK3 (CAS 330645-48-2), with molecular formula C13H16N4O2S and molecular weight 292.0994 g/mol. IUPAC: 6-amino-3-(methoxymethyl)spiro[2H-pyrano[2,3-c]pyrazole-4,4'-thiane]-5-carbonitrile.

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