N-[(5-bromo-2-methoxyphenyl)methyl]-3-{[(4-methylphenyl)methyl]sulfanyl}propanamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-3-{[(4-methylphenyl)methyl]sulfanyl}propanamide
N-[(5-bromo-2-methoxyphenyl)methyl]-3-{[(4-methylphenyl)methyl]sulfanyl}propanamide
Compound characteristics
| Compound ID: | K786-6252 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-3-{[(4-methylphenyl)methyl]sulfanyl}propanamide |
| Molecular Weight: | 408.36 |
| Molecular Formula: | C19 H22 Br N O2 S |
| Smiles: | Cc1ccc(CSCCC(NCc2cc(ccc2OC)[Br])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5799 |
| logD: | 4.5799 |
| logSw: | -4.4751 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.069 |
| InChI Key: | FOKYFBVSIFMGBX-UHFFFAOYSA-N |