N-{3-(4-chlorophenyl)-2-[(furan-2-carbonyl)amino]prop-2-enoyl}-beta-alanine
Chemical Structure Depiction of
N-{3-(4-chlorophenyl)-2-[(furan-2-carbonyl)amino]prop-2-enoyl}-beta-alanine
N-{3-(4-chlorophenyl)-2-[(furan-2-carbonyl)amino]prop-2-enoyl}-beta-alanine
Compound characteristics
| Compound ID: | 3379-2676 |
| Compound Name: | N-{3-(4-chlorophenyl)-2-[(furan-2-carbonyl)amino]prop-2-enoyl}-beta-alanine |
| Molecular Weight: | 362.77 |
| Molecular Formula: | C17 H15 Cl N2 O5 |
| Smiles: | C(CNC(/C(=C/c1ccc(cc1)[Cl])NC(c1ccco1)=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2763 |
| logD: | -1.4194 |
| logSw: | -2.5696 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 83.652 |
| InChI Key: | KWIVRQHBCYQKAN-UHFFFAOYSA-N |