methyl 1,5-dimethyl-4-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1,5-dimethyl-4-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
methyl 1,5-dimethyl-4-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F639-0168 |
| Compound Name: | methyl 1,5-dimethyl-4-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 379.44 |
| Molecular Formula: | C16 H21 N5 O4 S |
| Smiles: | Cc1c(cc(C(=O)OC)n1C)S(N1CCN(CC1)c1ncccn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9888 |
| logD: | 0.9888 |
| logSw: | -1.9547 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.778 |
| InChI Key: | ZORPSVFKDSPACB-UHFFFAOYSA-N |