N-{(3,4-dimethoxyanilino)[(prop-2-en-1-yl)amino]methylidene}methanesulfonamide
Chemical Structure Depiction of
N-{(3,4-dimethoxyanilino)[(prop-2-en-1-yl)amino]methylidene}methanesulfonamide
N-{(3,4-dimethoxyanilino)[(prop-2-en-1-yl)amino]methylidene}methanesulfonamide
Compound characteristics
| Compound ID: | L261-0558 |
| Compound Name: | N-{(3,4-dimethoxyanilino)[(prop-2-en-1-yl)amino]methylidene}methanesulfonamide |
| Molecular Weight: | 313.37 |
| Molecular Formula: | C13 H19 N3 O4 S |
| Smiles: | COc1ccc(cc1OC)NC(/NCC=C)=N/S(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0939 |
| logD: | 1.0938 |
| logSw: | -2.3157 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.744 |
| InChI Key: | BZERMNUCEKCSMV-UHFFFAOYSA-N |