2-[(acenaphtho[1,2-e][1,2,4]triazin-9-yl)sulfanyl]-N-(2-bromophenyl)acetamide
Chemical Structure Depiction of
2-[(acenaphtho[1,2-e][1,2,4]triazin-9-yl)sulfanyl]-N-(2-bromophenyl)acetamide
2-[(acenaphtho[1,2-e][1,2,4]triazin-9-yl)sulfanyl]-N-(2-bromophenyl)acetamide
Compound characteristics
| Compound ID: | 4206-0028 |
| Compound Name: | 2-[(acenaphtho[1,2-e][1,2,4]triazin-9-yl)sulfanyl]-N-(2-bromophenyl)acetamide |
| Molecular Weight: | 449.33 |
| Molecular Formula: | C21 H13 Br N4 O S |
| Smiles: | C(C(Nc1ccccc1[Br])=O)Sc1nc2c3cccc4cccc(c34)c2nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.7355 |
| logD: | 4.7355 |
| logSw: | -5.9928 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.556 |
| InChI Key: | KLPDUJQYQLMZSL-UHFFFAOYSA-N |