N-(1-benzylpiperidin-4-yl)-4-tert-butyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-4-tert-butyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
N-(1-benzylpiperidin-4-yl)-4-tert-butyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F915-0574 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-4-tert-butyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 590.69 |
| Molecular Formula: | C29 H40 N4 O2 |
| Salt: | CF3COOH |
| Smiles: | CC(C)(C)c1ccc(cc1)C(N(CC(N1CCNCC1)=O)C1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7041 |
| logD: | 2.7253 |
| logSw: | -3.8022 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.316 |
| InChI Key: | WSEGSMDQFNJHMN-UHFFFAOYSA-N |