4-[2-(diethylcarbamoyl)-4-(2-methylpropanamido)phenyl]-N-(2-fluorophenyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[2-(diethylcarbamoyl)-4-(2-methylpropanamido)phenyl]-N-(2-fluorophenyl)-1,4-diazepane-1-carboxamide
4-[2-(diethylcarbamoyl)-4-(2-methylpropanamido)phenyl]-N-(2-fluorophenyl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V026-1762 |
| Compound Name: | 4-[2-(diethylcarbamoyl)-4-(2-methylpropanamido)phenyl]-N-(2-fluorophenyl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 497.61 |
| Molecular Formula: | C27 H36 F N5 O3 |
| Salt: | not_available |
| Smiles: | CCN(CC)C(c1cc(ccc1N1CCCN(CC1)C(Nc1ccccc1F)=O)NC(C(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9664 |
| logD: | 3.9624 |
| logSw: | -3.9968 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.595 |
| InChI Key: | QLHOPUGEPXXWID-UHFFFAOYSA-N |