4-chloro-N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Chemical Structure Depiction of
4-chloro-N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
4-chloro-N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Compound characteristics
Compound ID: | V020-4868 |
Compound Name: | 4-chloro-N-ethyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide |
Molecular Weight: | 495.98 |
Molecular Formula: | C26 H27 Cl F N5 O2 |
Smiles: | CCN(CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)F)nn1)=O)C(c1ccc(cc1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 3.9143 |
logD: | 3.9124 |
logSw: | -4.332 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 57.093 |
InChI Key: | XAXRSCYNNYDINN-UHFFFAOYSA-N |