N-tert-butyl-4-[4-(2-chlorobenzamido)-2-(diethylcarbamoyl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-tert-butyl-4-[4-(2-chlorobenzamido)-2-(diethylcarbamoyl)phenyl]piperazine-1-carboxamide
N-tert-butyl-4-[4-(2-chlorobenzamido)-2-(diethylcarbamoyl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V012-9861 |
| Compound Name: | N-tert-butyl-4-[4-(2-chlorobenzamido)-2-(diethylcarbamoyl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 514.07 |
| Molecular Formula: | C27 H36 Cl N5 O3 |
| Salt: | not_available |
| Smiles: | CCN(CC)C(c1cc(ccc1N1CCN(CC1)C(NC(C)(C)C)=O)NC(c1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3031 |
| logD: | 4.302 |
| logSw: | -4.5098 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.108 |
| InChI Key: | BMXKGMFALADSOH-UHFFFAOYSA-N |