2-[(7-{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethan-1-ol
Chemical Structure Depiction of
2-[(7-{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethan-1-ol
2-[(7-{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethan-1-ol
Compound characteristics
| Compound ID: | C091-0290 |
| Compound Name: | 2-[(7-{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethan-1-ol |
| Molecular Weight: | 462.89 |
| Molecular Formula: | C20 H23 Cl N6 O5 |
| Smiles: | C(CO)Nc1cc(c2c(c1[N+]([O-])=O)non2)N1CCN(CC1)CCOc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9063 |
| logD: | 3.8842 |
| logSw: | -4.4241 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.272 |
| InChI Key: | OCRYDQNOOSBDCU-UHFFFAOYSA-N |