ethyl 4-{4-[(4-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzene-1-sulfonyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{4-[(4-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzene-1-sulfonyl}piperazine-1-carboxylate
ethyl 4-{4-[(4-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzene-1-sulfonyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | C059-0022 |
| Compound Name: | ethyl 4-{4-[(4-methoxy-1,3-benzothiazol-2-yl)carbamoyl]benzene-1-sulfonyl}piperazine-1-carboxylate |
| Molecular Weight: | 504.58 |
| Molecular Formula: | C22 H24 N4 O6 S2 |
| Smiles: | CCOC(N1CCN(CC1)S(c1ccc(cc1)C(Nc1nc2c(cccc2s1)OC)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4765 |
| logD: | 3.4742 |
| logSw: | -3.719 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.983 |
| InChI Key: | CLDKQWJBGCJTSE-UHFFFAOYSA-N |