2-[(7-{[3-(4-ethylpiperazin-1-yl)propyl]amino}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethan-1-ol
Chemical Structure Depiction of
2-[(7-{[3-(4-ethylpiperazin-1-yl)propyl]amino}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethan-1-ol
2-[(7-{[3-(4-ethylpiperazin-1-yl)propyl]amino}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethan-1-ol
Compound characteristics
| Compound ID: | C091-0332 |
| Compound Name: | 2-[(7-{[3-(4-ethylpiperazin-1-yl)propyl]amino}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethan-1-ol |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C17 H27 N7 O4 |
| Smiles: | CCN1CCN(CCCNc2cc(c(c3c2non3)[N+]([O-])=O)NCCO)CC1 |
| Stereo: | ACHIRAL |
| logP: | 1.2695 |
| logD: | 0.3213 |
| logSw: | -1.7805 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 113.081 |
| InChI Key: | GJCOZLGMIWSLGP-UHFFFAOYSA-N |