3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}-N-[(3-methylpyridin-2-yl)methyl]propanamide
Chemical Structure Depiction of
3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}-N-[(3-methylpyridin-2-yl)methyl]propanamide
3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}-N-[(3-methylpyridin-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | V003-1000 |
| Compound Name: | 3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}-N-[(3-methylpyridin-2-yl)methyl]propanamide |
| Molecular Weight: | 471.62 |
| Molecular Formula: | C28 H29 N3 O2 S |
| Salt: | not_available |
| Smiles: | Cc1cccnc1CNC(CCc1ccc(c2ccc(cc2)OC)n1c1ccc(cc1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8541 |
| logD: | 5.853 |
| logSw: | -5.4213 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.453 |
| InChI Key: | UWDFQJXKVGCBBI-UHFFFAOYSA-N |