AC1LYLWU
(5E)-5-[[1-(4-bromo-3-methylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(thiophen-2-ylmethyl)-1,3-diazinane-2,4,6-trione
Also Known As: (E)-5-((1-(4-bromo-3-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-(thiophen-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione|(5E)-5-[[1-(4-bromo-3-methylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(thiophen-2-ylmethyl)-1,3-diazinane-2,4,6-trione|(5E)-5-{[1-(4-bromo-3-methylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-6-hydroxy-3-(thiophen-2-ylmethyl)pyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C23H20BrN3O3S |
|---|---|
| Molecular Weight | 497.0409 g/mol |
| LogP | 4.88856 |
| Topological Polar Surface Area | 71.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 497.0409 |
| Monoisotopic Mass | 497.0409 |
| Heavy Atoms | 31 |
| Complexity | 1241.2454 |
Chemical Identifiers
| CAS Number | 836624-77-2 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC(=C(C=C2)Br)C)C)/C=C/3\C(=O)NC(=O)N(C3=O)CC4=CC=CS4 |
Product Overview
AC1LYLWU (CAS 836624-77-2), with molecular formula C23H20BrN3O3S and molecular weight 497.0409 g/mol. IUPAC: (5E)-5-[[1-(4-bromo-3-methylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(thiophen-2-ylmethyl)-1,3-diazinane-2,4,6-trione.