N-ethyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide
Chemical Structure Depiction of
N-ethyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide
N-ethyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide
Compound characteristics
| Compound ID: | V016-5506 |
| Compound Name: | N-ethyl-N-(2-{4-[6-(3-methoxyphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-3-methylbutanamide |
| Molecular Weight: | 453.58 |
| Molecular Formula: | C25 H35 N5 O3 |
| Smiles: | CCN(CC(N1CCCN(CC1)c1ccc(c2cccc(c2)OC)nn1)=O)C(CC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2215 |
| logD: | 3.0515 |
| logSw: | -3.369 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.381 |
| InChI Key: | MNTVPVIHIRSYIV-UHFFFAOYSA-N |