ethyl 3,5-dimethyl-4-[3-methyl-4-(3-methylphenyl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-[3-methyl-4-(3-methylphenyl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-[3-methyl-4-(3-methylphenyl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F378-0095 |
| Compound Name: | ethyl 3,5-dimethyl-4-[3-methyl-4-(3-methylphenyl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 419.54 |
| Molecular Formula: | C21 H29 N3 O4 S |
| Smiles: | CCOC(c1c(C)c(c(C)[nH]1)S(N1CCN(C(C)C1)c1cccc(C)c1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4955 |
| logD: | 3.4955 |
| logSw: | -3.6309 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.163 |
| InChI Key: | ULUXSWNCHYHYPH-HNNXBMFYSA-N |