6-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methylphenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)pyridazin-3(2H)-one
Chemical Structure Depiction of
6-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methylphenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)pyridazin-3(2H)-one
6-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methylphenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F946-0086 |
| Compound Name: | 6-[3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-4-methylphenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)pyridazin-3(2H)-one |
| Molecular Weight: | 476.55 |
| Molecular Formula: | C25 H24 N4 O4 S |
| Smiles: | Cc1ccc(cc1S(N1CCc2ccccc2C1)(=O)=O)C1C=CC(N(c2c(C)noc2C)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0302 |
| logD: | 4.0302 |
| logSw: | -4.1997 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.938 |
| InChI Key: | ITRMNHIUQIKYIB-UHFFFAOYSA-N |