4-ethoxy-3-nitro-N-{3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}benzamide
Chemical Structure Depiction of
4-ethoxy-3-nitro-N-{3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}benzamide
4-ethoxy-3-nitro-N-{3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}benzamide
Compound characteristics
| Compound ID: | F019-0532 |
| Compound Name: | 4-ethoxy-3-nitro-N-{3-[5-(propan-2-yl)-1,3-benzoxazol-2-yl]phenyl}benzamide |
| Molecular Weight: | 445.47 |
| Molecular Formula: | C25 H23 N3 O5 |
| Smiles: | CCOc1ccc(cc1[N+]([O-])=O)C(Nc1cccc(c1)c1nc2cc(ccc2o1)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8019 |
| logD: | 5.8018 |
| logSw: | -5.5387 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.431 |
| InChI Key: | DCHZRHWWQGRXNB-UHFFFAOYSA-N |