4-[(benzylsulfanyl)methyl]-2-{1-[(4-methoxyphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
Chemical Structure Depiction of
4-[(benzylsulfanyl)methyl]-2-{1-[(4-methoxyphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
4-[(benzylsulfanyl)methyl]-2-{1-[(4-methoxyphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
Compound characteristics
| Compound ID: | C351-0276 |
| Compound Name: | 4-[(benzylsulfanyl)methyl]-2-{1-[(4-methoxyphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole |
| Molecular Weight: | 392.52 |
| Molecular Formula: | C23 H24 N2 O2 S |
| Smiles: | COc1ccc(Cn2cccc2C2=NC(CO2)CSCc2ccccc2)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9016 |
| logD: | 4.9015 |
| logSw: | -4.6579 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.7928 |
| InChI Key: | QAFLTJNHJDPOKT-HXUWFJFHSA-N |