2-{[7-(4-fluoroanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}ethan-1-ol
Chemical Structure Depiction of
2-{[7-(4-fluoroanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}ethan-1-ol
2-{[7-(4-fluoroanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}ethan-1-ol
Compound characteristics
| Compound ID: | C091-0045 |
| Compound Name: | 2-{[7-(4-fluoroanilino)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}ethan-1-ol |
| Molecular Weight: | 333.28 |
| Molecular Formula: | C14 H12 F N5 O4 |
| Smiles: | C(CO)Nc1cc(c2c(c1[N+]([O-])=O)non2)Nc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 3.2833 |
| logD: | 3.2833 |
| logSw: | -3.5518 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.398 |
| InChI Key: | FSXVBZCXRROIGQ-UHFFFAOYSA-N |