methyl 1-methyl-4-[3-methyl-4-(4-methylphenyl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1-methyl-4-[3-methyl-4-(4-methylphenyl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
methyl 1-methyl-4-[3-methyl-4-(4-methylphenyl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | E138-1097 |
| Compound Name: | methyl 1-methyl-4-[3-methyl-4-(4-methylphenyl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 391.49 |
| Molecular Formula: | C19 H25 N3 O4 S |
| Smiles: | CC1CN(CCN1c1ccc(C)cc1)S(c1cc(C(=O)OC)n(C)c1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3541 |
| logD: | 2.354 |
| logSw: | -2.6788 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.912 |
| InChI Key: | KQGOBLYMHWDYQK-HNNXBMFYSA-N |