AC1NYD4W structure

AC1NYD4W

1-[2-[6-[(E)-(1-hexyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1,3-dimethylthiourea

Also Known As: (E)-1-(2-(6-((1-hexyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea|1-(2-{6-[(E)-(1-hexyl-2-hydroxy-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-1,3-dimethylthiourea|1-[2-[6-[(E)-(1-hexyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1,3-dimethylthiourea

CAS: 673443-83-9
Molecular Formula C24H32N4O6S
Molecular Weight 504.20425 g/mol
LogP 2.4446
Topological Polar Surface Area 109.44 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 7
Rotatable Bonds 10
Exact Mass 504.20425
Monoisotopic Mass 504.20425
Heavy Atoms 35
Complexity 1041.3309

Chemical Identifiers

CAS Number 673443-83-9
SMILES CCCCCCN1C(=O)/C(=C/C2=C(C3=C(C=C2CCN(C)C(=S)NC)OCO3)OC)/C(=O)NC1=O

Product Overview

AC1NYD4W (CAS 673443-83-9), with molecular formula C24H32N4O6S and molecular weight 504.20425 g/mol. IUPAC: 1-[2-[6-[(E)-(1-hexyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1,3-dimethylthiourea.

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