ethyl 1-methyl-4-{2-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]pyrrolidine-1-sulfonyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1-methyl-4-{2-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]pyrrolidine-1-sulfonyl}-1H-pyrrole-2-carboxylate
ethyl 1-methyl-4-{2-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]pyrrolidine-1-sulfonyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F065-0563 |
| Compound Name: | ethyl 1-methyl-4-{2-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]pyrrolidine-1-sulfonyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 476.57 |
| Molecular Formula: | C21 H24 N4 O5 S2 |
| Smiles: | CCOC(c1cc(cn1C)S(N1CCCC1C(Nc1nc2ccc(C)cc2s1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0251 |
| logD: | 3.0243 |
| logSw: | -3.2576 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.702 |
| InChI Key: | DSNIFVHULULUMK-INIZCTEOSA-N |