3-fluoro-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-[2-(morpholin-4-yl)ethyl]benzamide
Chemical Structure Depiction of
3-fluoro-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-[2-(morpholin-4-yl)ethyl]benzamide
3-fluoro-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-[2-(morpholin-4-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | V028-0561 |
| Compound Name: | 3-fluoro-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-N-[2-(morpholin-4-yl)ethyl]benzamide |
| Molecular Weight: | 560.67 |
| Molecular Formula: | C31 H37 F N6 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)c1ccc(nn1)N1CCCN(CC1)C(CN(CCN1CCOCC1)C(c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.979 |
| logD: | 2.9458 |
| logSw: | -3.0235 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.966 |
| InChI Key: | ODYURIQQHGIVNH-UHFFFAOYSA-N |