2-{[4-nitro-7-(4-phenylpiperazin-1-yl)-2,1,3-benzoxadiazol-5-yl]amino}ethan-1-ol
Chemical Structure Depiction of
2-{[4-nitro-7-(4-phenylpiperazin-1-yl)-2,1,3-benzoxadiazol-5-yl]amino}ethan-1-ol
2-{[4-nitro-7-(4-phenylpiperazin-1-yl)-2,1,3-benzoxadiazol-5-yl]amino}ethan-1-ol
Compound characteristics
Compound ID: | K901-0670 |
Compound Name: | 2-{[4-nitro-7-(4-phenylpiperazin-1-yl)-2,1,3-benzoxadiazol-5-yl]amino}ethan-1-ol |
Molecular Weight: | 384.39 |
Molecular Formula: | C18 H20 N6 O4 |
Smiles: | C(CO)Nc1cc(c2c(c1[N+]([O-])=O)non2)N1CCN(CC1)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 3.3499 |
logD: | 3.3499 |
logSw: | -3.6555 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 102.596 |
InChI Key: | NBIILMDNLMXQLQ-UHFFFAOYSA-N |