2-(1H-benzotriazol-1-yl)-3-[(pyridin-2-yl)amino]naphthalene-1,4-dione
Chemical Structure Depiction of
2-(1H-benzotriazol-1-yl)-3-[(pyridin-2-yl)amino]naphthalene-1,4-dione
2-(1H-benzotriazol-1-yl)-3-[(pyridin-2-yl)amino]naphthalene-1,4-dione
Compound characteristics
| Compound ID: | 8016-0696 |
| Compound Name: | 2-(1H-benzotriazol-1-yl)-3-[(pyridin-2-yl)amino]naphthalene-1,4-dione |
| Molecular Weight: | 367.37 |
| Molecular Formula: | C21 H13 N5 O2 |
| Smiles: | c1ccc2C(C(=C(C(c2c1)=O)Nc1ccccn1)n1c2ccccc2nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2291 |
| logD: | 2.4397 |
| logSw: | -4.0151 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.659 |
| InChI Key: | VNYJAHQXYXJVNK-UHFFFAOYSA-N |