ethyl 3,5-dimethyl-4-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F378-0168 |
| Compound Name: | ethyl 3,5-dimethyl-4-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 393.46 |
| Molecular Formula: | C17 H23 N5 O4 S |
| Smiles: | CCOC(c1c(C)c(c(C)[nH]1)S(N1CCN(CC1)c1ncccn1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8098 |
| logD: | 1.8098 |
| logSw: | -2.3872 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.307 |
| InChI Key: | XYDHIALSXMGWRR-UHFFFAOYSA-N |