N-[(2-chloro-4-fluorophenyl)methyl]-3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}propanamide
Chemical Structure Depiction of
N-[(2-chloro-4-fluorophenyl)methyl]-3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}propanamide
N-[(2-chloro-4-fluorophenyl)methyl]-3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}propanamide
Compound characteristics
| Compound ID: | V002-0077 |
| Compound Name: | N-[(2-chloro-4-fluorophenyl)methyl]-3-{5-(4-methoxyphenyl)-1-[4-(methylsulfanyl)phenyl]-1H-pyrrol-2-yl}propanamide |
| Molecular Weight: | 509.04 |
| Molecular Formula: | C28 H26 Cl F N2 O2 S |
| Smiles: | COc1ccc(cc1)c1ccc(CCC(NCc2ccc(cc2[Cl])F)=O)n1c1ccc(cc1)SC |
| Stereo: | ACHIRAL |
| logP: | 7.2187 |
| logD: | 7.2187 |
| logSw: | -6.5361 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.139 |
| InChI Key: | YGOMPBXSLZQHDS-UHFFFAOYSA-N |