4-(4-{[N-(2-chlorobenzoyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-(2-fluorophenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-{[N-(2-chlorobenzoyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-(2-fluorophenyl)piperazine-1-carboxamide
4-(4-{[N-(2-chlorobenzoyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-(2-fluorophenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V027-8019 |
| Compound Name: | 4-(4-{[N-(2-chlorobenzoyl)-N-(prop-2-en-1-yl)glycyl]amino}phenyl)-N-(2-fluorophenyl)piperazine-1-carboxamide |
| Molecular Weight: | 550.03 |
| Molecular Formula: | C29 H29 Cl F N5 O3 |
| Salt: | not_available |
| Smiles: | C=CCN(CC(Nc1ccc(cc1)N1CCN(CC1)C(Nc1ccccc1F)=O)=O)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5943 |
| logD: | 4.5881 |
| logSw: | -4.7063 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.609 |
| InChI Key: | QCUVERUTXLMKHP-UHFFFAOYSA-N |