4-{2-(2-bromobenzamido)-3-[4-(diethylamino)phenyl]prop-2-enamido}butanoic acid
Chemical Structure Depiction of
4-{2-(2-bromobenzamido)-3-[4-(diethylamino)phenyl]prop-2-enamido}butanoic acid
4-{2-(2-bromobenzamido)-3-[4-(diethylamino)phenyl]prop-2-enamido}butanoic acid
Compound characteristics
| Compound ID: | 2509-0070 |
| Compound Name: | 4-{2-(2-bromobenzamido)-3-[4-(diethylamino)phenyl]prop-2-enamido}butanoic acid |
| Molecular Weight: | 502.41 |
| Molecular Formula: | C24 H28 Br N3 O4 |
| Smiles: | CCN(CC)c1ccc(\C=C(/C(NCCCC(O)=O)=O)NC(c2ccccc2[Br])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9427 |
| logD: | 0.1218 |
| logSw: | -3.6289 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.809 |
| InChI Key: | WSXIOUOCUMJBOS-UHFFFAOYSA-N |