2-({[4-(1,3-benzoxazol-2-yl)phenyl]imino}methyl)-4-chloro-3,5-dimethyl-6-nitrophenol
Chemical Structure Depiction of
2-({[4-(1,3-benzoxazol-2-yl)phenyl]imino}methyl)-4-chloro-3,5-dimethyl-6-nitrophenol
2-({[4-(1,3-benzoxazol-2-yl)phenyl]imino}methyl)-4-chloro-3,5-dimethyl-6-nitrophenol
Compound characteristics
| Compound ID: | 8005-7918 |
| Compound Name: | 2-({[4-(1,3-benzoxazol-2-yl)phenyl]imino}methyl)-4-chloro-3,5-dimethyl-6-nitrophenol |
| Molecular Weight: | 421.84 |
| Molecular Formula: | C22 H16 Cl N3 O4 |
| Smiles: | Cc1c(/C=N/c2ccc(cc2)c2nc3ccccc3o2)c(c(c(C)c1[Cl])[N+]([O-])=O)O |
| Stereo: | ACHIRAL |
| logP: | 6.2226 |
| logD: | 4.4426 |
| logSw: | -6.0167 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.435 |
| InChI Key: | QSNDCKHVSDUDTC-UHFFFAOYSA-N |