ethyl 3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)-1H-pyrazole-5-carboxylate
Chemical Structure Depiction of
ethyl 3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)-1H-pyrazole-5-carboxylate
ethyl 3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)-1H-pyrazole-5-carboxylate
Compound characteristics
| Compound ID: | G695-0091 |
| Compound Name: | ethyl 3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)-1H-pyrazole-5-carboxylate |
| Molecular Weight: | 361.42 |
| Molecular Formula: | C17 H19 N3 O4 S |
| Smiles: | CCOC(c1cc(n[nH]1)S(N1CCC(=CC1)c1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1734 |
| logD: | 3.1644 |
| logSw: | -3.4257 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.968 |
| InChI Key: | TVVZCQAKKXKEKL-UHFFFAOYSA-N |