methyl 3-{3-[(2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Chemical Structure Depiction of
methyl 3-{3-[(2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
methyl 3-{3-[(2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Compound characteristics
| Compound ID: | 5609-1138 |
| Compound Name: | methyl 3-{3-[(2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate |
| Molecular Weight: | 415.45 |
| Molecular Formula: | C24 H21 N3 O4 |
| Smiles: | Cc1cc(\C=C2/C(N(C(N2)=O)c2ccccc2)=O)c(C)n1c1cccc(c1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.6668 |
| logD: | 3.6655 |
| logSw: | -3.9301 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.898 |
| InChI Key: | ORXPSFXDGAHNER-UHFFFAOYSA-N |