ethyl 3-{3-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Chemical Structure Depiction of
ethyl 3-{3-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
ethyl 3-{3-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Compound characteristics
| Compound ID: | 4281-2733 |
| Compound Name: | ethyl 3-{3-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate |
| Molecular Weight: | 399.45 |
| Molecular Formula: | C25 H21 N O4 |
| Smiles: | CCOC(c1cccc(c1)n1c(C)cc(C=C2C(c3ccccc3C2=O)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7375 |
| logD: | 4.7375 |
| logSw: | -4.617 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.965 |
| InChI Key: | RRFYTNJZAKXYFA-UHFFFAOYSA-N |