methyl {3-[4-methyl-3-(pyrrolidine-1-sulfonyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetate
Chemical Structure Depiction of
methyl {3-[4-methyl-3-(pyrrolidine-1-sulfonyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetate
methyl {3-[4-methyl-3-(pyrrolidine-1-sulfonyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetate
Compound characteristics
| Compound ID: | D315-1271 |
| Compound Name: | methyl {3-[4-methyl-3-(pyrrolidine-1-sulfonyl)phenyl]-6-oxopyridazin-1(6H)-yl}acetate |
| Molecular Weight: | 391.44 |
| Molecular Formula: | C18 H21 N3 O5 S |
| Smiles: | Cc1ccc(cc1S(N1CCCC1)(=O)=O)C1C=CC(N(CC(=O)OC)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7257 |
| logD: | 1.7257 |
| logSw: | -2.5244 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.475 |
| InChI Key: | QJKDSIHVRDJYNO-UHFFFAOYSA-N |