N-(3-{2-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1-[4-(diethylamino)phenyl]-3-oxoprop-1-en-2-yl)benzamide
Chemical Structure Depiction of
N-(3-{2-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1-[4-(diethylamino)phenyl]-3-oxoprop-1-en-2-yl)benzamide
N-(3-{2-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1-[4-(diethylamino)phenyl]-3-oxoprop-1-en-2-yl)benzamide
Compound characteristics
| Compound ID: | 8003-1492 |
| Compound Name: | N-(3-{2-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1-[4-(diethylamino)phenyl]-3-oxoprop-1-en-2-yl)benzamide |
| Molecular Weight: | 563.45 |
| Molecular Formula: | C28 H27 Br N4 O4 |
| Smiles: | CCN(CC)c1ccc(\C=C(/C(N/N=C/c2cc3c(cc2[Br])OCO3)=O)NC(c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5597 |
| logD: | 3.6856 |
| logSw: | -5.4594 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.33 |
| InChI Key: | MDPYAIDQWQVMJA-UHFFFAOYSA-N |