N-[1-(4-bromophenyl)-3-(4-methylanilino)-3-oxoprop-1-en-2-yl]-4-butoxybenzamide
Chemical Structure Depiction of
N-[1-(4-bromophenyl)-3-(4-methylanilino)-3-oxoprop-1-en-2-yl]-4-butoxybenzamide
N-[1-(4-bromophenyl)-3-(4-methylanilino)-3-oxoprop-1-en-2-yl]-4-butoxybenzamide
Compound characteristics
| Compound ID: | 2447-3000 |
| Compound Name: | N-[1-(4-bromophenyl)-3-(4-methylanilino)-3-oxoprop-1-en-2-yl]-4-butoxybenzamide |
| Molecular Weight: | 507.43 |
| Molecular Formula: | C27 H27 Br N2 O3 |
| Smiles: | CCCCOc1ccc(cc1)C(NC(=C/c1ccc(cc1)[Br])\C(Nc1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9648 |
| logD: | 6.9051 |
| logSw: | -5.7092 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.672 |
| InChI Key: | YJJZESYWMSDUQF-UHFFFAOYSA-N |