[({5-methyl-2-[4-(methylsulfanyl)phenyl]-1,3-oxazol-4-yl}methyl)sulfanyl]acetic acid
Chemical Structure Depiction of
[({5-methyl-2-[4-(methylsulfanyl)phenyl]-1,3-oxazol-4-yl}methyl)sulfanyl]acetic acid
[({5-methyl-2-[4-(methylsulfanyl)phenyl]-1,3-oxazol-4-yl}methyl)sulfanyl]acetic acid
Compound characteristics
| Compound ID: | K780-0546 |
| Compound Name: | [({5-methyl-2-[4-(methylsulfanyl)phenyl]-1,3-oxazol-4-yl}methyl)sulfanyl]acetic acid |
| Molecular Weight: | 309.4 |
| Molecular Formula: | C14 H15 N O3 S2 |
| Smiles: | Cc1c(CSCC(O)=O)nc(c2ccc(cc2)SC)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.2362 |
| logD: | -0.2 |
| logSw: | -3.1972 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.744 |
| InChI Key: | KQHJAJCUAJNBAK-UHFFFAOYSA-N |