N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-oxo-1,4,5,6-tetrahydropyridazine-3-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-oxo-1,4,5,6-tetrahydropyridazine-3-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-oxo-1,4,5,6-tetrahydropyridazine-3-carboxamide
Compound characteristics
| Compound ID: | Y041-4933 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-oxo-1,4,5,6-tetrahydropyridazine-3-carboxamide |
| Molecular Weight: | 423.49 |
| Molecular Formula: | C19 H25 N3 O6 S |
| Smiles: | COc1ccc(CCNC(C2CCC(N(C3CCS(C3)(=O)=O)N=2)=O)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.466 |
| logD: | -0.466 |
| logSw: | -2.1632 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.186 |
| InChI Key: | FJEZCTLVYIHPCH-CQSZACIVSA-N |