3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-(2-phenoxyethyl)propanamide
Chemical Structure Depiction of
3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-(2-phenoxyethyl)propanamide
3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-(2-phenoxyethyl)propanamide
Compound characteristics
| Compound ID: | V031-0824 |
| Compound Name: | 3-{1-[4-(cyanomethyl)phenyl]-5-(2,4-dimethylphenyl)-1H-pyrrol-2-yl}-N-(2-phenoxyethyl)propanamide |
| Molecular Weight: | 477.61 |
| Molecular Formula: | C31 H31 N3 O2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(C)c1)c1ccc(CCC(NCCOc2ccccc2)=O)n1c1ccc(CC#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8261 |
| logD: | 5.8261 |
| logSw: | -5.4277 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.347 |
| InChI Key: | QSYWGGSVGJRHRC-UHFFFAOYSA-N |