N'-(4-{[(2-methylphenyl)methyl]sulfanyl}-3-nitrobenzoyl)furan-2-carbohydrazide
Chemical Structure Depiction of
N'-(4-{[(2-methylphenyl)methyl]sulfanyl}-3-nitrobenzoyl)furan-2-carbohydrazide
N'-(4-{[(2-methylphenyl)methyl]sulfanyl}-3-nitrobenzoyl)furan-2-carbohydrazide
Compound characteristics
| Compound ID: | K781-2700 |
| Compound Name: | N'-(4-{[(2-methylphenyl)methyl]sulfanyl}-3-nitrobenzoyl)furan-2-carbohydrazide |
| Molecular Weight: | 411.43 |
| Molecular Formula: | C20 H17 N3 O5 S |
| Smiles: | Cc1ccccc1CSc1ccc(cc1[N+]([O-])=O)C(NNC(c1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1565 |
| logD: | 4.1521 |
| logSw: | -4.2528 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.822 |
| InChI Key: | CZMLMPXNJGZQLP-UHFFFAOYSA-N |