ethyl 4-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F378-0475 |
| Compound Name: | ethyl 4-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 433.57 |
| Molecular Formula: | C22 H31 N3 O4 S |
| Smiles: | CCOC(c1c(C)c(c(C)n1C)S(N1CCN(CC1)c1cccc(C)c1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5901 |
| logD: | 3.5901 |
| logSw: | -3.7265 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.471 |
| InChI Key: | ZETXRBQBHLRIIB-UHFFFAOYSA-N |