2-bromo-N-{1-[4-(dimethylamino)phenyl]-3-[4-(hexyloxy)anilino]-3-oxoprop-1-en-2-yl}benzamide
Chemical Structure Depiction of
2-bromo-N-{1-[4-(dimethylamino)phenyl]-3-[4-(hexyloxy)anilino]-3-oxoprop-1-en-2-yl}benzamide
2-bromo-N-{1-[4-(dimethylamino)phenyl]-3-[4-(hexyloxy)anilino]-3-oxoprop-1-en-2-yl}benzamide
Compound characteristics
| Compound ID: | 2628-3118 |
| Compound Name: | 2-bromo-N-{1-[4-(dimethylamino)phenyl]-3-[4-(hexyloxy)anilino]-3-oxoprop-1-en-2-yl}benzamide |
| Molecular Weight: | 564.52 |
| Molecular Formula: | C30 H34 Br N3 O3 |
| Smiles: | CCCCCCOc1ccc(cc1)NC(/C(=C\c1ccc(cc1)N(C)C)NC(c1ccccc1[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.153 |
| logD: | 6.5991 |
| logSw: | -5.7659 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.477 |
| InChI Key: | HUCSFXPFXJBROR-UHFFFAOYSA-N |