4-chloro-2-({[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]imino}methyl)-6-nitrophenol
Chemical Structure Depiction of
4-chloro-2-({[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]imino}methyl)-6-nitrophenol
4-chloro-2-({[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]imino}methyl)-6-nitrophenol
Compound characteristics
| Compound ID: | 8002-1281 |
| Compound Name: | 4-chloro-2-({[2-(4-methylphenyl)-1,3-benzoxazol-5-yl]imino}methyl)-6-nitrophenol |
| Molecular Weight: | 407.81 |
| Molecular Formula: | C21 H14 Cl N3 O4 |
| Smiles: | Cc1ccc(cc1)c1nc2cc(ccc2o1)/N=C/c1cc(cc(c1O)[N+]([O-])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.8246 |
| logD: | 3.6015 |
| logSw: | -5.7918 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.736 |
| InChI Key: | MHEXTEFLVANKRO-UHFFFAOYSA-N |