N'-(4-{[(4-methylphenyl)methyl]sulfanyl}-3-nitrobenzoyl)pyridine-4-carbohydrazide
Chemical Structure Depiction of
N'-(4-{[(4-methylphenyl)methyl]sulfanyl}-3-nitrobenzoyl)pyridine-4-carbohydrazide
N'-(4-{[(4-methylphenyl)methyl]sulfanyl}-3-nitrobenzoyl)pyridine-4-carbohydrazide
Compound characteristics
| Compound ID: | K781-2232 |
| Compound Name: | N'-(4-{[(4-methylphenyl)methyl]sulfanyl}-3-nitrobenzoyl)pyridine-4-carbohydrazide |
| Molecular Weight: | 422.46 |
| Molecular Formula: | C21 H18 N4 O4 S |
| Smiles: | Cc1ccc(CSc2ccc(cc2[N+]([O-])=O)C(NNC(c2ccncc2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1299 |
| logD: | 3.1003 |
| logSw: | -3.3032 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.672 |
| InChI Key: | UIUGTBMXKBPBFK-UHFFFAOYSA-N |