ethyl 4-{3-[(6-chloro-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-sulfonyl}-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-{3-[(6-chloro-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-sulfonyl}-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
ethyl 4-{3-[(6-chloro-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-sulfonyl}-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | G937-1653 |
| Compound Name: | ethyl 4-{3-[(6-chloro-1,3-benzothiazol-2-yl)carbamoyl]piperidine-1-sulfonyl}-1,2,5-trimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 539.07 |
| Molecular Formula: | C23 H27 Cl N4 O5 S2 |
| Smiles: | CCOC(c1c(c(C)n(C)c1C)S(N1CCCC(C1)C(Nc1nc2ccc(cc2s1)[Cl])=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4348 |
| logD: | 3.4267 |
| logSw: | -4.3127 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.268 |
| InChI Key: | WXNMWQSFLFHJQE-HNNXBMFYSA-N |