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
| 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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