ethyl N-{4-[(1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}-beta-alaninate
Chemical Structure Depiction of
ethyl N-{4-[(1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}-beta-alaninate
ethyl N-{4-[(1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}-beta-alaninate
Compound characteristics
| Compound ID: | F874-0504 |
| Compound Name: | ethyl N-{4-[(1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}-beta-alaninate |
| Molecular Weight: | 360.41 |
| Molecular Formula: | C18 H24 N4 O4 |
| Smiles: | [H]c1ccc2c(c1)oc(CN1CCN(CC1)C(NCCC(=O)OCC)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 1.7136 |
| logD: | 1.6903 |
| logSw: | -2.171 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.589 |
| InChI Key: | ZSGWXVSENSWNFF-UHFFFAOYSA-N |