N-butyl-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-methylpropanamide
Chemical Structure Depiction of
N-butyl-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-methylpropanamide
N-butyl-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-methylpropanamide
Compound characteristics
| Compound ID: | V028-1947 |
| Compound Name: | N-butyl-N-(2-{4-[6-(4-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-2-methylpropanamide |
| Molecular Weight: | 467.61 |
| Molecular Formula: | C26 H37 N5 O3 |
| Smiles: | CCCCN(CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)OC)nn1)=O)C(C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9211 |
| logD: | 3.9173 |
| logSw: | -3.9297 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.162 |
| InChI Key: | ZJLDGCHLVBXLKZ-UHFFFAOYSA-N |