4-chloro-2-({[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-3,5-dimethyl-6-nitrophenol
Chemical Structure Depiction of
4-chloro-2-({[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-3,5-dimethyl-6-nitrophenol
4-chloro-2-({[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-3,5-dimethyl-6-nitrophenol
Compound characteristics
| Compound ID: | 8005-7361 |
| Compound Name: | 4-chloro-2-({[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)-3,5-dimethyl-6-nitrophenol |
| Molecular Weight: | 439.83 |
| Molecular Formula: | C22 H15 Cl F N3 O4 |
| Smiles: | Cc1c(/C=N/c2ccc3c(c2)nc(c2cccc(c2)F)o3)c(c(c(C)c1[Cl])[N+]([O-])=O)O |
| Stereo: | ACHIRAL |
| logP: | 6.2443 |
| logD: | 4.4642 |
| logSw: | -5.9619 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.435 |
| InChI Key: | UEMDPPQZVQJQIL-UHFFFAOYSA-N |