N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-ethyl-3-fluorobenzamide
Chemical Structure Depiction of
N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-ethyl-3-fluorobenzamide
N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-ethyl-3-fluorobenzamide
Compound characteristics
| Compound ID: | V021-1800 |
| Compound Name: | N-(2-{4-[6-(2-chlorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-ethyl-3-fluorobenzamide |
| Molecular Weight: | 495.98 |
| Molecular Formula: | C26 H27 Cl F N5 O2 |
| Smiles: | CCN(CC(N1CCCN(CC1)c1ccc(c2ccccc2[Cl])nn1)=O)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5841 |
| logD: | 3.578 |
| logSw: | -3.9611 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.093 |
| InChI Key: | VEXBBZHHTZZQCL-UHFFFAOYSA-N |