N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N'-ethylurea
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N'-ethylurea
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N'-ethylurea
Compound characteristics
| Compound ID: | V009-1985 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-(2-{4-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-N'-ethylurea |
| Molecular Weight: | 562.63 |
| Molecular Formula: | C29 H34 N6 O6 |
| Salt: | not_available |
| Smiles: | CCNC(N(CC(N1CCN(CC1)c1ccc(c2ccc(cc2OC)OC)nn1)=O)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7215 |
| logD: | 2.7186 |
| logSw: | -3.2318 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.096 |
| InChI Key: | VFQDGIFFXKGCTG-UHFFFAOYSA-N |