3-bromophenyl 4-({[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]imino}methyl)benzoate
Chemical Structure Depiction of
3-bromophenyl 4-({[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]imino}methyl)benzoate
3-bromophenyl 4-({[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]imino}methyl)benzoate
Compound characteristics
| Compound ID: | 0808-0189 |
| Compound Name: | 3-bromophenyl 4-({[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]imino}methyl)benzoate |
| Molecular Weight: | 513.35 |
| Molecular Formula: | C27 H17 Br N2 O4 |
| Smiles: | C(\c1ccc(cc1)C(=O)Oc1cccc(c1)[Br])=N/c1ccc(c(c1)c1nc2ccccc2o1)O |
| Stereo: | ACHIRAL |
| logP: | 6.7552 |
| logD: | 6.7536 |
| logSw: | -6.0153 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.102 |
| InChI Key: | KZRNVSMDUUMETD-UHFFFAOYSA-N |