2,2'-{[5-(5-{[(2,3-dibromo-6-hydroxy-5-methoxyphenyl)methylidene]amino}-1,3-benzoxazol-2-yl)-1,3-phenylene]bis(azanylylidenemethanylylidene)}bis(3,4-dibromo-6-methoxyphenol)
Chemical Structure Depiction of
2,2'-{[5-(5-{[(2,3-dibromo-6-hydroxy-5-methoxyphenyl)methylidene]amino}-1,3-benzoxazol-2-yl)-1,3-phenylene]bis(azanylylidenemethanylylidene)}bis(3,4-dibromo-6-methoxyphenol)
2,2'-{[5-(5-{[(2,3-dibromo-6-hydroxy-5-methoxyphenyl)methylidene]amino}-1,3-benzoxazol-2-yl)-1,3-phenylene]bis(azanylylidenemethanylylidene)}bis(3,4-dibromo-6-methoxyphenol)
Compound characteristics
| Compound ID: | 8005-6798 |
| Compound Name: | 2,2'-{[5-(5-{[(2,3-dibromo-6-hydroxy-5-methoxyphenyl)methylidene]amino}-1,3-benzoxazol-2-yl)-1,3-phenylene]bis(azanylylidenemethanylylidene)}bis(3,4-dibromo-6-methoxyphenol) |
| Molecular Weight: | 1116.05 |
| Molecular Formula: | C37 H24 Br6 N4 O7 |
| Smiles: | COc1cc(c(c(/C=N/c2ccc3c(c2)nc(c2cc(cc(c2)/N=C/c2c(c(cc(c2[Br])[Br])OC)O)/N=C/c2c(c(cc(c2[Br])[Br])OC)O)o3)c1O)[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 10.2909 |
| logD: | 9.8229 |
| logSw: | -5.7394 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 110.76 |
| InChI Key: | YFAJYEVLEYIMGF-UHFFFAOYSA-N |