methyl 4-({[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)benzoate
methyl 4-({[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)benzoate
Compound characteristics
| Compound ID: | 8005-6345 |
| Compound Name: | methyl 4-({[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]imino}methyl)benzoate |
| Molecular Weight: | 425.27 |
| Molecular Formula: | C22 H14 Cl2 N2 O3 |
| Smiles: | COC(c1ccc(/C=N/c2ccc3c(c2)nc(c2ccc(cc2[Cl])[Cl])o3)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9171 |
| logD: | 5.9169 |
| logSw: | -6.1742 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.35 |
| InChI Key: | HKTXNUOZCVVQAC-UHFFFAOYSA-N |