N-benzyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methoxybenzamide
Chemical Structure Depiction of
N-benzyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methoxybenzamide
N-benzyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methoxybenzamide
Compound characteristics
| Compound ID: | V008-0668 |
| Compound Name: | N-benzyl-N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methoxybenzamide |
| Molecular Weight: | 553.64 |
| Molecular Formula: | C32 H32 F N5 O3 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(N(CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)F)nn1)=O)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3319 |
| logD: | 4.33 |
| logSw: | -4.3688 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.64 |
| InChI Key: | ZQYMGCIPXUSJLA-UHFFFAOYSA-N |