2-bromo-6-[({2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl}imino)methyl]-4-nitrophenol
Chemical Structure Depiction of
2-bromo-6-[({2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl}imino)methyl]-4-nitrophenol
2-bromo-6-[({2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl}imino)methyl]-4-nitrophenol
Compound characteristics
| Compound ID: | 1550-0328 |
| Compound Name: | 2-bromo-6-[({2-[(4-chlorophenyl)methyl]-1,3-benzoxazol-5-yl}imino)methyl]-4-nitrophenol |
| Molecular Weight: | 486.71 |
| Molecular Formula: | C21 H13 Br Cl N3 O4 |
| Smiles: | C(c1ccc(cc1)[Cl])c1nc2cc(ccc2o1)/N=C/c1cc(cc(c1O)[Br])[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.3405 |
| logD: | 3.2562 |
| logSw: | -6.1479 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.702 |
| InChI Key: | AHBFOASNDXMQDU-UHFFFAOYSA-N |