5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-carboxylic acid
Chemical Structure Depiction of
5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-carboxylic acid
5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-carboxylic acid
Compound characteristics
| Compound ID: | R152-2003 |
| Compound Name: | 5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-carboxylic acid |
| Molecular Weight: | 262.32 |
| Molecular Formula: | C14 H14 O3 S |
| Smiles: | Cc1ccc(CSCc2ccc(C(O)=O)o2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3817 |
| logD: | -0.6022 |
| logSw: | -3.2127 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.216 |
| InChI Key: | WYLCOKVKQDPXQZ-UHFFFAOYSA-N |