methyl 3-ethyl-5-[4-(furan-2-carbonyl)piperazine-1-sulfonyl]-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
methyl 3-ethyl-5-[4-(furan-2-carbonyl)piperazine-1-sulfonyl]-1H-pyrazole-4-carboxylate
methyl 3-ethyl-5-[4-(furan-2-carbonyl)piperazine-1-sulfonyl]-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | F421-3330 |
| Compound Name: | methyl 3-ethyl-5-[4-(furan-2-carbonyl)piperazine-1-sulfonyl]-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 396.42 |
| Molecular Formula: | C16 H20 N4 O6 S |
| Smiles: | CCc1c(C(=O)OC)c([nH]n1)S(N1CCN(CC1)C(c1ccco1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6136 |
| logD: | 0.4689 |
| logSw: | -2.233 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.73 |
| InChI Key: | TXMFYNLCPDZNIE-UHFFFAOYSA-N |