2-({6-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)-1-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)ethan-1-one
Chemical Structure Depiction of
2-({6-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)-1-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)ethan-1-one
2-({6-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)-1-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)ethan-1-one
Compound characteristics
| Compound ID: | L383-0212 |
| Compound Name: | 2-({6-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-yl}sulfanyl)-1-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)ethan-1-one |
| Molecular Weight: | 479.58 |
| Molecular Formula: | C25 H26 F N5 O2 S |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CSc1ccc(nn1)N1CCN(CC1)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4043 |
| logD: | 4.4043 |
| logSw: | -4.3184 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.255 |
| InChI Key: | GOHMNOLZVMWGSD-UHFFFAOYSA-N |