N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methoxybenzamide
Chemical Structure Depiction of
N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methoxybenzamide
N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methoxybenzamide
Compound characteristics
| Compound ID: | V020-4887 |
| Compound Name: | N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methoxybenzamide |
| Molecular Weight: | 491.57 |
| Molecular Formula: | C27 H30 F N5 O3 |
| Smiles: | CCN(CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)F)nn1)=O)C(c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2976 |
| logD: | 3.2958 |
| logSw: | -3.4296 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.637 |
| InChI Key: | VLAADNWMPOYKEH-UHFFFAOYSA-N |