N-(4-methylphenyl)-2-[4-(prop-2-ynoyl)piperazin-1-yl]acetamide
Chemical Structure Depiction of
N-(4-methylphenyl)-2-[4-(prop-2-ynoyl)piperazin-1-yl]acetamide
N-(4-methylphenyl)-2-[4-(prop-2-ynoyl)piperazin-1-yl]acetamide
Compound characteristics
| Compound ID: | T001-1420 |
| Compound Name: | N-(4-methylphenyl)-2-[4-(prop-2-ynoyl)piperazin-1-yl]acetamide |
| Molecular Weight: | 285.34 |
| Molecular Formula: | C16 H19 N3 O2 |
| Smiles: | Cc1ccc(cc1)NC(CN1CCN(CC1)C(C#C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7281 |
| logD: | 1.7281 |
| logSw: | -2.3134 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.321 |
| InChI Key: | VPNTUKPFFIZQTP-UHFFFAOYSA-N |