2-[(7-{[3-(4-methylpiperidin-1-yl)propyl]amino}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethan-1-ol
Chemical Structure Depiction of
2-[(7-{[3-(4-methylpiperidin-1-yl)propyl]amino}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethan-1-ol
2-[(7-{[3-(4-methylpiperidin-1-yl)propyl]amino}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethan-1-ol
Compound characteristics
| Compound ID: | C091-0304 |
| Compound Name: | 2-[(7-{[3-(4-methylpiperidin-1-yl)propyl]amino}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethan-1-ol |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C17 H26 N6 O4 |
| Smiles: | CC1CCN(CCCNc2cc(c(c3c2non3)[N+]([O-])=O)NCCO)CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.509 |
| logD: | 0.6761 |
| logSw: | -2.4606 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 109.545 |
| InChI Key: | PGLDGRWWAQWCLZ-UHFFFAOYSA-N |