N'-(4-{[(4-methylphenyl)methyl]sulfanyl}-3-nitrobenzoyl)pyridine-2-carbohydrazide
Chemical Structure Depiction of
N'-(4-{[(4-methylphenyl)methyl]sulfanyl}-3-nitrobenzoyl)pyridine-2-carbohydrazide
N'-(4-{[(4-methylphenyl)methyl]sulfanyl}-3-nitrobenzoyl)pyridine-2-carbohydrazide
Compound characteristics
| Compound ID: | K781-2668 |
| Compound Name: | N'-(4-{[(4-methylphenyl)methyl]sulfanyl}-3-nitrobenzoyl)pyridine-2-carbohydrazide |
| Molecular Weight: | 422.46 |
| Molecular Formula: | C21 H18 N4 O4 S |
| Smiles: | Cc1ccc(CSc2ccc(cc2[N+]([O-])=O)C(NNC(c2ccccn2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4124 |
| logD: | 3.3503 |
| logSw: | -3.9253 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.292 |
| InChI Key: | KLHXSZFBPFRJKJ-UHFFFAOYSA-N |