4-{[2-(4-nitrobenzoyl)hydrazinylidene]methyl}phenyl 3-chloro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
4-{[2-(4-nitrobenzoyl)hydrazinylidene]methyl}phenyl 3-chloro-1-benzothiophene-2-carboxylate
4-{[2-(4-nitrobenzoyl)hydrazinylidene]methyl}phenyl 3-chloro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 8006-3812 |
| Compound Name: | 4-{[2-(4-nitrobenzoyl)hydrazinylidene]methyl}phenyl 3-chloro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 479.9 |
| Molecular Formula: | C23 H14 Cl N3 O5 S |
| Smiles: | C(\c1ccc(cc1)OC(c1c(c2ccccc2s1)[Cl])=O)=N/NC(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6896 |
| logD: | 5.6772 |
| logSw: | -6.2368 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.06 |
| InChI Key: | PGKUGQZDOFQRIE-UHFFFAOYSA-N |