methyl 2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylate
Chemical Structure Depiction of
methyl 2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylate
methyl 2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylate
Compound characteristics
| Compound ID: | C505-0406 |
| Compound Name: | methyl 2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-1,3-benzothiazole-6-carboxylate |
| Molecular Weight: | 371.43 |
| Molecular Formula: | C17 H13 N3 O3 S2 |
| Smiles: | COC(c1ccc2c(c1)sc(Nc1nc3ccc(cc3s1)OC)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5118 |
| logD: | 5.5117 |
| logSw: | -5.4998 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.391 |
| InChI Key: | YRCGMAXGOOVABK-UHFFFAOYSA-N |