methyl 4-{3-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Chemical Structure Depiction of
methyl 4-{3-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
methyl 4-{3-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Compound characteristics
| Compound ID: | 3609-0114 |
| Compound Name: | methyl 4-{3-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate |
| Molecular Weight: | 385.42 |
| Molecular Formula: | C24 H19 N O4 |
| Smiles: | Cc1cc(C=C2C(c3ccccc3C2=O)=O)c(C)n1c1ccc(cc1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.2636 |
| logD: | 4.2636 |
| logSw: | -4.4406 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.385 |
| InChI Key: | IKZMCEGCTBVWEZ-UHFFFAOYSA-N |