1-(4-fluorophenyl)-4-oxo-N-(3-{[(oxolan-2-yl)methyl]carbamoyl}-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,4-dihydropyridazine-3-carboxamide
Chemical Structure Depiction of
1-(4-fluorophenyl)-4-oxo-N-(3-{[(oxolan-2-yl)methyl]carbamoyl}-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,4-dihydropyridazine-3-carboxamide
1-(4-fluorophenyl)-4-oxo-N-(3-{[(oxolan-2-yl)methyl]carbamoyl}-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,4-dihydropyridazine-3-carboxamide
Compound characteristics
| Compound ID: | D223-0982 |
| Compound Name: | 1-(4-fluorophenyl)-4-oxo-N-(3-{[(oxolan-2-yl)methyl]carbamoyl}-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1,4-dihydropyridazine-3-carboxamide |
| Molecular Weight: | 496.56 |
| Molecular Formula: | C25 H25 F N4 O4 S |
| Smiles: | [H]N(C(C1C(C=CN(c2ccc(cc2)F)N=1)=O)=O)c1c(C(NCC2CCCO2)=O)c2CCCCc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0002 |
| logD: | -0.98 |
| logSw: | -3.5088 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.523 |
| InChI Key: | ZTQQRPXQTVZGOG-QGZVFWFLSA-N |