N-{3-(2-bromo-4-methylanilino)-1-[4-(dimethylamino)phenyl]-3-oxoprop-1-en-2-yl}-4-butoxybenzamide
Chemical Structure Depiction of
N-{3-(2-bromo-4-methylanilino)-1-[4-(dimethylamino)phenyl]-3-oxoprop-1-en-2-yl}-4-butoxybenzamide
N-{3-(2-bromo-4-methylanilino)-1-[4-(dimethylamino)phenyl]-3-oxoprop-1-en-2-yl}-4-butoxybenzamide
Compound characteristics
| Compound ID: | 2125-0667 |
| Compound Name: | N-{3-(2-bromo-4-methylanilino)-1-[4-(dimethylamino)phenyl]-3-oxoprop-1-en-2-yl}-4-butoxybenzamide |
| Molecular Weight: | 550.5 |
| Molecular Formula: | C29 H32 Br N3 O3 |
| Smiles: | CCCCOc1ccc(cc1)C(NC(=C\c1ccc(cc1)N(C)C)\C(Nc1ccc(C)cc1[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7772 |
| logD: | 6.419 |
| logSw: | -5.5076 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.779 |
| InChI Key: | WUDIPQQIEBNLGO-ZXVVBBHZSA-N |