3-fluoro-N-(2-methoxyethyl)-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Chemical Structure Depiction of
3-fluoro-N-(2-methoxyethyl)-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
3-fluoro-N-(2-methoxyethyl)-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide
Compound characteristics
| Compound ID: | V001-7889 |
| Compound Name: | 3-fluoro-N-(2-methoxyethyl)-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)benzamide |
| Molecular Weight: | 505.59 |
| Molecular Formula: | C28 H32 F N5 O3 |
| Smiles: | Cc1ccc(cc1)c1ccc(nn1)N1CCCN(CC1)C(CN(CCOC)C(c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.328 |
| logD: | 3.2947 |
| logSw: | -3.4725 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.689 |
| InChI Key: | SCOXKXBDJXIHSR-UHFFFAOYSA-N |