3-methyl-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,2-oxazol-5(4H)-one
Chemical Structure Depiction of
3-methyl-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,2-oxazol-5(4H)-one
3-methyl-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,2-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 8011-7607 |
| Compound Name: | 3-methyl-4-{[4-(methylsulfanyl)phenyl]methylidene}-1,2-oxazol-5(4H)-one |
| Molecular Weight: | 233.29 |
| Molecular Formula: | C12 H11 N O2 S |
| Smiles: | CC1/C(=C/c2ccc(cc2)SC)C(=O)ON=1 |
| Stereo: | ACHIRAL |
| logP: | 2.7312 |
| logD: | 2.7312 |
| logSw: | -2.9405 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.136 |
| InChI Key: | RHZAVLPYPYVIKW-UHFFFAOYSA-N |