N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide
Compound characteristics
| Compound ID: | Y040-8744 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanamide |
| Molecular Weight: | 396.44 |
| Molecular Formula: | C21 H24 N4 O4 |
| Smiles: | COc1ccc(CCNC(CCCN2C(c3ccccc3N=N2)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.1707 |
| logD: | 1.1707 |
| logSw: | -2.2671 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.485 |
| InChI Key: | LEXAQIQMIQTWMM-UHFFFAOYSA-N |