N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide
Chemical Structure Depiction of
N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide
N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide
Compound characteristics
| Compound ID: | V028-5106 |
| Compound Name: | N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C24 H32 F N5 O2 |
| Salt: | not_available |
| Smiles: | CCN(CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)F)nn1)=O)C(CC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.312 |
| logD: | 3.3101 |
| logSw: | -3.4018 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.837 |
| InChI Key: | KGNOQNQANNKASC-UHFFFAOYSA-N |