5-{[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
5-{[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione
5-{[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | 8010-1831 |
| Compound Name: | 5-{[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione |
| Molecular Weight: | 404.26 |
| Molecular Formula: | C19 H18 Br N O4 |
| Smiles: | Cc1cc(C=C2C(=O)OC(C)(C)OC2=O)c(C)n1c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.9502 |
| logD: | 3.9502 |
| logSw: | -4.088 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.109 |
| InChI Key: | XFXZFODLFFKDGN-UHFFFAOYSA-N |