N-[3-(4-chlorophenyl)-2-(4-methylbenzamido)prop-2-enoyl]-beta-alanine
Chemical Structure Depiction of
N-[3-(4-chlorophenyl)-2-(4-methylbenzamido)prop-2-enoyl]-beta-alanine
N-[3-(4-chlorophenyl)-2-(4-methylbenzamido)prop-2-enoyl]-beta-alanine
Compound characteristics
| Compound ID: | 5613-0174 |
| Compound Name: | N-[3-(4-chlorophenyl)-2-(4-methylbenzamido)prop-2-enoyl]-beta-alanine |
| Molecular Weight: | 386.83 |
| Molecular Formula: | C20 H19 Cl N2 O4 |
| Smiles: | Cc1ccc(cc1)C(NC(=C\c1ccc(cc1)[Cl])\C(NCCC(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4271 |
| logD: | -0.2685 |
| logSw: | -3.3977 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.073 |
| InChI Key: | OWZUZZFJVBXEAZ-UHFFFAOYSA-N |