N-tert-butyl-4-(4-{[N-(2-chlorobenzoyl)-N-(propan-2-yl)glycyl]amino}phenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-tert-butyl-4-(4-{[N-(2-chlorobenzoyl)-N-(propan-2-yl)glycyl]amino}phenyl)piperazine-1-carboxamide
N-tert-butyl-4-(4-{[N-(2-chlorobenzoyl)-N-(propan-2-yl)glycyl]amino}phenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V028-2245 |
| Compound Name: | N-tert-butyl-4-(4-{[N-(2-chlorobenzoyl)-N-(propan-2-yl)glycyl]amino}phenyl)piperazine-1-carboxamide |
| Molecular Weight: | 514.07 |
| Molecular Formula: | C27 H36 Cl N5 O3 |
| Salt: | not_available |
| Smiles: | CC(C)N(CC(Nc1ccc(cc1)N1CCN(CC1)C(NC(C)(C)C)=O)=O)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4311 |
| logD: | 4.409 |
| logSw: | -4.4973 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.49 |
| InChI Key: | BIPATFMRKZZBQV-UHFFFAOYSA-N |