3-butyl-5-[2-(2-chloroanilino)-1,3-thiazol-4-yl]-5-methyloxolan-2-one
Chemical Structure Depiction of
3-butyl-5-[2-(2-chloroanilino)-1,3-thiazol-4-yl]-5-methyloxolan-2-one
3-butyl-5-[2-(2-chloroanilino)-1,3-thiazol-4-yl]-5-methyloxolan-2-one
Compound characteristics
| Compound ID: | 4075-3402 |
| Compound Name: | 3-butyl-5-[2-(2-chloroanilino)-1,3-thiazol-4-yl]-5-methyloxolan-2-one |
| Molecular Weight: | 364.89 |
| Molecular Formula: | C18 H21 Cl N2 O2 S |
| Smiles: | CCCCC1CC(C)(c2csc(Nc3ccccc3[Cl])n2)OC1=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.9581 |
| logD: | 5.9581 |
| logSw: | -5.8607 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.987 |
| InChI Key: | KQRNFZDKZGTCJL-UHFFFAOYSA-N |