methyl 4-[4-(4-acetylphenyl)piperazine-1-sulfonyl]-1,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-[4-(4-acetylphenyl)piperazine-1-sulfonyl]-1,5-dimethyl-1H-pyrrole-2-carboxylate
methyl 4-[4-(4-acetylphenyl)piperazine-1-sulfonyl]-1,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F639-0118 |
| Compound Name: | methyl 4-[4-(4-acetylphenyl)piperazine-1-sulfonyl]-1,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C20 H25 N3 O5 S |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)S(c1cc(C(=O)OC)n(C)c1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4878 |
| logD: | 1.4878 |
| logSw: | -2.4174 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.243 |
| InChI Key: | NYIBBEKJJUTXGF-UHFFFAOYSA-N |