N'-[(3-{[(1,3-benzoxazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)methylidene]-2-chloro-4-nitrobenzohydrazide
Chemical Structure Depiction of
N'-[(3-{[(1,3-benzoxazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)methylidene]-2-chloro-4-nitrobenzohydrazide
N'-[(3-{[(1,3-benzoxazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)methylidene]-2-chloro-4-nitrobenzohydrazide
Compound characteristics
| Compound ID: | 2064-1368 |
| Compound Name: | N'-[(3-{[(1,3-benzoxazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)methylidene]-2-chloro-4-nitrobenzohydrazide |
| Molecular Weight: | 496.93 |
| Molecular Formula: | C23 H17 Cl N4 O5 S |
| Smiles: | COc1ccc(/C=N/NC(c2ccc(cc2[Cl])[N+]([O-])=O)=O)cc1CSc1nc2ccccc2o1 |
| Stereo: | ACHIRAL |
| logP: | 5.6549 |
| logD: | 5.6344 |
| logSw: | -6.0667 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.958 |
| InChI Key: | UQVXDYKECFNDDR-UHFFFAOYSA-N |