N-(3-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1-[4-(diethylamino)phenyl]-3-oxoprop-1-en-2-yl)-2-chlorobenzamide
Chemical Structure Depiction of
N-(3-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1-[4-(diethylamino)phenyl]-3-oxoprop-1-en-2-yl)-2-chlorobenzamide
N-(3-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1-[4-(diethylamino)phenyl]-3-oxoprop-1-en-2-yl)-2-chlorobenzamide
Compound characteristics
| Compound ID: | 8001-9092 |
| Compound Name: | N-(3-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-1-[4-(diethylamino)phenyl]-3-oxoprop-1-en-2-yl)-2-chlorobenzamide |
| Molecular Weight: | 519 |
| Molecular Formula: | C28 H27 Cl N4 O4 |
| Smiles: | CCN(CC)c1ccc(\C=C(/C(N/N=C/c2ccc3c(c2)OCO3)=O)NC(c2ccccc2[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5268 |
| logD: | 2.7185 |
| logSw: | -5.8172 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.33 |
| InChI Key: | WCSPQPJTFOONBR-UHFFFAOYSA-N |