N-benzyl-N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-fluorobenzamide
Chemical Structure Depiction of
N-benzyl-N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-fluorobenzamide
N-benzyl-N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-fluorobenzamide
Compound characteristics
| Compound ID: | V007-7912 |
| Compound Name: | N-benzyl-N-(2-{4-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-fluorobenzamide |
| Molecular Weight: | 583.66 |
| Molecular Formula: | C33 H34 F N5 O4 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1OC)c1ccc(nn1)N1CCCN(CC1)C(CN(Cc1ccccc1)C(c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.864 |
| logD: | 3.751 |
| logSw: | -4.0412 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.357 |
| InChI Key: | XFFBXEUPKQRKMA-UHFFFAOYSA-N |