ethyl 2,5-dimethyl-4-{3-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-sulfonyl}-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2,5-dimethyl-4-{3-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-sulfonyl}-1H-pyrrole-3-carboxylate
ethyl 2,5-dimethyl-4-{3-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-sulfonyl}-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G937-1349 |
| Compound Name: | ethyl 2,5-dimethyl-4-{3-[(6-methyl-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-sulfonyl}-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 504.63 |
| Molecular Formula: | C23 H28 N4 O5 S2 |
| Smiles: | CCOC(c1c(c(C)[nH]c1C)S(N1CCCC(C1)C(Nc1nc2ccc(C)cc2s1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5342 |
| logD: | 3.5336 |
| logSw: | -3.855 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.277 |
| InChI Key: | ONKOAQWWCMWQHG-INIZCTEOSA-N |