2-({4-nitro-7-[4-(pyridin-2-yl)piperazin-1-yl]-2,1,3-benzoxadiazol-5-yl}amino)ethan-1-ol
Chemical Structure Depiction of
2-({4-nitro-7-[4-(pyridin-2-yl)piperazin-1-yl]-2,1,3-benzoxadiazol-5-yl}amino)ethan-1-ol
2-({4-nitro-7-[4-(pyridin-2-yl)piperazin-1-yl]-2,1,3-benzoxadiazol-5-yl}amino)ethan-1-ol
Compound characteristics
| Compound ID: | K781-8272 |
| Compound Name: | 2-({4-nitro-7-[4-(pyridin-2-yl)piperazin-1-yl]-2,1,3-benzoxadiazol-5-yl}amino)ethan-1-ol |
| Molecular Weight: | 385.38 |
| Molecular Formula: | C17 H19 N7 O4 |
| Smiles: | C(CO)Nc1cc(c2c(c1[N+]([O-])=O)non2)N1CCN(CC1)c1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 3.0176 |
| logD: | 3.0119 |
| logSw: | -3.3654 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 111.107 |
| InChI Key: | XJTSLLPGVWHUHB-UHFFFAOYSA-N |