4-chloro-N-{3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-1H-pyrrol-2-yl}benzamide
Chemical Structure Depiction of
4-chloro-N-{3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-1H-pyrrol-2-yl}benzamide
4-chloro-N-{3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-1H-pyrrol-2-yl}benzamide
Compound characteristics
| Compound ID: | 5991-0736 |
| Compound Name: | 4-chloro-N-{3-cyano-1-[(4-methoxyphenyl)methyl]-4,5-diphenyl-1H-pyrrol-2-yl}benzamide |
| Molecular Weight: | 518.01 |
| Molecular Formula: | C32 H24 Cl N3 O2 |
| Smiles: | COc1ccc(Cn2c(c3ccccc3)c(c3ccccc3)c(C#N)c2NC(c2ccc(cc2)[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 7.2982 |
| logD: | 7.2981 |
| logSw: | -6.4661 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.785 |
| InChI Key: | BDJADILVIBCUAD-UHFFFAOYSA-N |