methyl {3-[4-methyl-3-(piperidine-1-sulfonyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetate
Chemical Structure Depiction of
methyl {3-[4-methyl-3-(piperidine-1-sulfonyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetate
methyl {3-[4-methyl-3-(piperidine-1-sulfonyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetate
Compound characteristics
| Compound ID: | D315-1190 |
| Compound Name: | methyl {3-[4-methyl-3-(piperidine-1-sulfonyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetate |
| Molecular Weight: | 405.47 |
| Molecular Formula: | C19 H23 N3 O5 S |
| Smiles: | Cc1ccc(cc1S(N1CCCCC1)(=O)=O)C1C=CC(N(CC(=O)OC)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0562 |
| logD: | 2.0562 |
| logSw: | -2.6323 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.109 |
| InChI Key: | UMFQBQGADAPZRC-UHFFFAOYSA-N |