N-tert-butyl-4-[4-(2-fluorobenzamido)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-tert-butyl-4-[4-(2-fluorobenzamido)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide
N-tert-butyl-4-[4-(2-fluorobenzamido)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V005-7790 |
| Compound Name: | N-tert-butyl-4-[4-(2-fluorobenzamido)-2-(piperidine-1-carbonyl)phenyl]-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 523.65 |
| Molecular Formula: | C29 H38 F N5 O3 |
| Salt: | not_available |
| Smiles: | CC(C)(C)NC(N1CCCN(CC1)c1ccc(cc1C(N1CCCCC1)=O)NC(c1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4485 |
| logD: | 4.4338 |
| logSw: | -4.2661 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.155 |
| InChI Key: | RUARVHOMOQVFRI-UHFFFAOYSA-N |