ethyl 4-(4-benzylpiperazine-1-sulfonyl)-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-benzylpiperazine-1-sulfonyl)-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
ethyl 4-(4-benzylpiperazine-1-sulfonyl)-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | E966-1359 |
| Compound Name: | ethyl 4-(4-benzylpiperazine-1-sulfonyl)-1,2,5-trimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 419.54 |
| Molecular Formula: | C21 H29 N3 O4 S |
| Smiles: | CCOC(c1c(c(C)n(C)c1C)S(N1CCN(CC1)Cc1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8924 |
| logD: | 1.8855 |
| logSw: | -2.2891 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.022 |
| InChI Key: | FNXKRPSDMIIZGG-UHFFFAOYSA-N |