N-(2,5-dimethoxyphenyl)-2-(4-fluorophenyl)-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-2-(4-fluorophenyl)-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
N-(2,5-dimethoxyphenyl)-2-(4-fluorophenyl)-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
Compound characteristics
| Compound ID: | E697-0669 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-2-(4-fluorophenyl)-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxamide |
| Molecular Weight: | 426.45 |
| Molecular Formula: | C22 H23 F N4 O4 |
| Smiles: | COc1ccc(c(c1)NC(N1CCC2(CC1)NC(C(c1ccc(cc1)F)=N2)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.3778 |
| logD: | 2.373 |
| logSw: | -3.0922 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.535 |
| InChI Key: | LUPWWGVHAJMFST-UHFFFAOYSA-N |