N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-4-methyl-N-[2-(morpholin-4-yl)ethyl]benzamide
Chemical Structure Depiction of
N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-4-methyl-N-[2-(morpholin-4-yl)ethyl]benzamide
N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-4-methyl-N-[2-(morpholin-4-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | V007-5713 |
| Compound Name: | N-(2-{4-[6-(4-fluorophenyl)pyridazin-3-yl]-1,4-diazepan-1-yl}-2-oxoethyl)-4-methyl-N-[2-(morpholin-4-yl)ethyl]benzamide |
| Molecular Weight: | 560.67 |
| Molecular Formula: | C31 H37 F N6 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(N(CCN1CCOCC1)CC(N1CCCN(CC1)c1ccc(c2ccc(cc2)F)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9694 |
| logD: | 2.9648 |
| logSw: | -2.9367 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.966 |
| InChI Key: | MLMSXCAEARYNBZ-UHFFFAOYSA-N |