N-{3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-1H-pyrrol-2-yl}-2-methoxybenzamide
Chemical Structure Depiction of
N-{3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-1H-pyrrol-2-yl}-2-methoxybenzamide
N-{3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-1H-pyrrol-2-yl}-2-methoxybenzamide
Compound characteristics
| Compound ID: | 5991-0774 |
| Compound Name: | N-{3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-1H-pyrrol-2-yl}-2-methoxybenzamide |
| Molecular Weight: | 513.6 |
| Molecular Formula: | C33 H27 N3 O3 |
| Smiles: | COc1ccc(Cn2c(c3ccccc3)c(c3ccccc3)c(C#N)c2NC(c2ccccc2OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.5285 |
| logD: | 6.5283 |
| logSw: | -5.8926 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.416 |
| InChI Key: | DZTOIJJLKKLTNF-UHFFFAOYSA-N |