3-(4-{[3-(4-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetyl}piperazin-1-yl)-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
3-(4-{[3-(4-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetyl}piperazin-1-yl)-1lambda~6~-thiolane-1,1-dione
3-(4-{[3-(4-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetyl}piperazin-1-yl)-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | Y041-4378 |
| Compound Name: | 3-(4-{[3-(4-methoxyphenyl)-6-oxopyridazin-1(6H)-yl]acetyl}piperazin-1-yl)-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 446.52 |
| Molecular Formula: | C21 H26 N4 O5 S |
| Smiles: | COc1ccc(cc1)C1C=CC(N(CC(N2CCN(CC2)C2CCS(C2)(=O)=O)=O)N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.1134 |
| logD: | -0.1135 |
| logSw: | -1.9716 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.014 |
| InChI Key: | XOYFSBHCTJMMOW-QGZVFWFLSA-N |