6-(5-{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]piperidine-1-sulfonyl}thiophen-2-yl)pyridazin-3(2H)-one
Chemical Structure Depiction of
6-(5-{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]piperidine-1-sulfonyl}thiophen-2-yl)pyridazin-3(2H)-one
6-(5-{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]piperidine-1-sulfonyl}thiophen-2-yl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | G115-0539 |
| Compound Name: | 6-(5-{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]piperidine-1-sulfonyl}thiophen-2-yl)pyridazin-3(2H)-one |
| Molecular Weight: | 470.61 |
| Molecular Formula: | C23 H26 N4 O3 S2 |
| Smiles: | C1CN(CCC1CN1CCc2ccccc2C1)S(c1ccc(C2C=CC(NN=2)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9748 |
| logD: | 2.4996 |
| logSw: | -4.1517 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.499 |
| InChI Key: | QICKBZABACLBLR-UHFFFAOYSA-N |