3-chloro-N'-({4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}methylidene)-1-benzothiophene-2-carbohydrazide
Chemical Structure Depiction of
3-chloro-N'-({4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}methylidene)-1-benzothiophene-2-carbohydrazide
3-chloro-N'-({4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}methylidene)-1-benzothiophene-2-carbohydrazide
Compound characteristics
| Compound ID: | Y508-7565 |
| Compound Name: | 3-chloro-N'-({4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}methylidene)-1-benzothiophene-2-carbohydrazide |
| Molecular Weight: | 469.9 |
| Molecular Formula: | C21 H16 Cl N5 O4 S |
| Smiles: | COc1ccc(/C=N/NC(c2c(c3ccccc3s2)[Cl])=O)cc1Cn1cc(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5722 |
| logD: | 4.5694 |
| logSw: | -5.0411 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.819 |
| InChI Key: | RVFARWMBYLDIBT-UHFFFAOYSA-N |