benzyl N-[2-benzamido-3-(furan-2-yl)prop-2-enoyl]-beta-alaninate
Chemical Structure Depiction of
benzyl N-[2-benzamido-3-(furan-2-yl)prop-2-enoyl]-beta-alaninate
benzyl N-[2-benzamido-3-(furan-2-yl)prop-2-enoyl]-beta-alaninate
Compound characteristics
| Compound ID: | 3632-0076 |
| Compound Name: | benzyl N-[2-benzamido-3-(furan-2-yl)prop-2-enoyl]-beta-alaninate |
| Molecular Weight: | 418.45 |
| Molecular Formula: | C24 H22 N2 O5 |
| Smiles: | C(CNC(/C(=C\c1ccco1)NC(c1ccccc1)=O)=O)C(=O)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9934 |
| logD: | 2.486 |
| logSw: | -3.4099 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.701 |
| InChI Key: | PNMAOBHGLKCMPW-UHFFFAOYSA-N |