propyl 4-[2-(3-oxo-1,2-benzothiazol-2(3H)-yl)acetamido]benzoate
Chemical Structure Depiction of
propyl 4-[2-(3-oxo-1,2-benzothiazol-2(3H)-yl)acetamido]benzoate
propyl 4-[2-(3-oxo-1,2-benzothiazol-2(3H)-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | Y042-4173 |
| Compound Name: | propyl 4-[2-(3-oxo-1,2-benzothiazol-2(3H)-yl)acetamido]benzoate |
| Molecular Weight: | 370.43 |
| Molecular Formula: | C19 H18 N2 O4 S |
| Smiles: | CCCOC(c1ccc(cc1)NC(CN1C(c2ccccc2S1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7623 |
| logD: | 3.7623 |
| logSw: | -3.9736 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.824 |
| InChI Key: | WYPRALUJJZIUMB-UHFFFAOYSA-N |