3-(2-chloro-3,4,5-trimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid
Chemical Structure Depiction of
3-(2-chloro-3,4,5-trimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid
3-(2-chloro-3,4,5-trimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid
Compound characteristics
| Compound ID: | Y507-0472 |
| Compound Name: | 3-(2-chloro-3,4,5-trimethoxyphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid |
| Molecular Weight: | 315.71 |
| Molecular Formula: | C13 H14 Cl N O6 |
| Smiles: | COc1cc(C2CC(C(O)=O)ON=2)c(c(c1OC)OC)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2098 |
| logD: | -1.2697 |
| logSw: | -3.1386 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.305 |
| InChI Key: | WXNLLUXMWJBDLU-SECBINFHSA-N |