4-(4-acetamido-2-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)-N-tert-butylpiperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-acetamido-2-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)-N-tert-butylpiperazine-1-carboxamide
4-(4-acetamido-2-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)-N-tert-butylpiperazine-1-carboxamide
Compound characteristics
| Compound ID: | V026-0245 |
| Compound Name: | 4-(4-acetamido-2-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)-N-tert-butylpiperazine-1-carboxamide |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C25 H32 F N5 O3 |
| Smiles: | CC(Nc1ccc(c(c1)C(NCc1ccc(cc1)F)=O)N1CCN(CC1)C(NC(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2761 |
| logD: | 3.2756 |
| logSw: | -3.6168 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.76 |
| InChI Key: | DKLLOLVLKIIJKT-UHFFFAOYSA-N |