methyl 4-phenyl-3-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 4-phenyl-3-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thiophene-2-carboxylate
methyl 4-phenyl-3-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G225-0243 |
| Compound Name: | methyl 4-phenyl-3-[4-(pyrimidin-2-yl)piperazine-1-sulfonyl]thiophene-2-carboxylate |
| Molecular Weight: | 444.53 |
| Molecular Formula: | C20 H20 N4 O4 S2 |
| Smiles: | COC(c1c(c(cs1)c1ccccc1)S(N1CCN(CC1)c1ncccn1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3287 |
| logD: | 3.3287 |
| logSw: | -3.6203 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.493 |
| InChI Key: | CVQBHOYALNWOEE-UHFFFAOYSA-N |