N-[(3,4-dimethylphenyl)methyl]-3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}propanamide
Chemical Structure Depiction of
N-[(3,4-dimethylphenyl)methyl]-3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}propanamide
N-[(3,4-dimethylphenyl)methyl]-3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}propanamide
Compound characteristics
| Compound ID: | V009-6819 |
| Compound Name: | N-[(3,4-dimethylphenyl)methyl]-3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}propanamide |
| Molecular Weight: | 484.66 |
| Molecular Formula: | C30 H32 N2 O2 S |
| Smiles: | Cc1ccc(CNC(CCc2ccc(c3ccc(cc3)OC)n2c2ccc(cc2)SC)=O)cc1C |
| Stereo: | ACHIRAL |
| logP: | 7.2156 |
| logD: | 7.2156 |
| logSw: | -5.6031 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.139 |
| InChI Key: | LBBNBHZKRAWOFC-UHFFFAOYSA-N |