methyl [2-(4-methylanilino)-4-oxo-1,3-thiazol-5(4H)-ylidene]acetate
Chemical Structure Depiction of
methyl [2-(4-methylanilino)-4-oxo-1,3-thiazol-5(4H)-ylidene]acetate
methyl [2-(4-methylanilino)-4-oxo-1,3-thiazol-5(4H)-ylidene]acetate
Compound characteristics
| Compound ID: | 6186-2125 |
| Compound Name: | methyl [2-(4-methylanilino)-4-oxo-1,3-thiazol-5(4H)-ylidene]acetate |
| Molecular Weight: | 276.31 |
| Molecular Formula: | C13 H12 N2 O3 S |
| Smiles: | Cc1ccc(cc1)NC1=NC(/C(=C/C(=O)OC)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3423 |
| logD: | 2.34 |
| logSw: | -2.9264 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.475 |
| InChI Key: | LDNDWYXPTHYYEN-UHFFFAOYSA-N |