ethyl 4-{3-[(2,5-dioxoimidazolidin-4-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{3-[(2,5-dioxoimidazolidin-4-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
ethyl 4-{3-[(2,5-dioxoimidazolidin-4-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Compound characteristics
| Compound ID: | 3609-0217 |
| Compound Name: | ethyl 4-{3-[(2,5-dioxoimidazolidin-4-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate |
| Molecular Weight: | 353.38 |
| Molecular Formula: | C19 H19 N3 O4 |
| Smiles: | CCOC(c1ccc(cc1)n1c(C)cc(/C=C2/C(NC(N2)=O)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5303 |
| logD: | 2.5298 |
| logSw: | -3.0677 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.73 |
| InChI Key: | CBVIOULWOANZLY-UHFFFAOYSA-N |