methyl 1,5-dimethyl-4-[4-(pyridin-2-yl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 1,5-dimethyl-4-[4-(pyridin-2-yl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
methyl 1,5-dimethyl-4-[4-(pyridin-2-yl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | F639-0131 |
| Compound Name: | methyl 1,5-dimethyl-4-[4-(pyridin-2-yl)piperazine-1-sulfonyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C17 H22 N4 O4 S |
| Smiles: | Cc1c(cc(C(=O)OC)n1C)S(N1CCN(CC1)c1ccccn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4918 |
| logD: | 1.4675 |
| logSw: | -2.3218 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.927 |
| InChI Key: | DDBYBTVXMUVMQE-UHFFFAOYSA-N |