1,3-dichloropropan-2-yl 4-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-4-oxobutanoate
Chemical Structure Depiction of
1,3-dichloropropan-2-yl 4-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-4-oxobutanoate
1,3-dichloropropan-2-yl 4-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-4-oxobutanoate
Compound characteristics
| Compound ID: | Y500-9338 |
| Compound Name: | 1,3-dichloropropan-2-yl 4-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-4-oxobutanoate |
| Molecular Weight: | 405.3 |
| Molecular Formula: | C16 H18 Cl2 N2 O4 S |
| Smiles: | CCOc1ccc2c(c1)sc(NC(CCC(=O)OC(C[Cl])C[Cl])=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.5811 |
| logD: | 3.581 |
| logSw: | -3.7787 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.877 |
| InChI Key: | JSTWUEQKINOVOZ-UHFFFAOYSA-N |