N'-(2-bromobenzoyl)-3-nitro-4-{[(oxolan-2-yl)methyl]sulfanyl}benzohydrazide
Chemical Structure Depiction of
N'-(2-bromobenzoyl)-3-nitro-4-{[(oxolan-2-yl)methyl]sulfanyl}benzohydrazide
N'-(2-bromobenzoyl)-3-nitro-4-{[(oxolan-2-yl)methyl]sulfanyl}benzohydrazide
Compound characteristics
| Compound ID: | K781-3489 |
| Compound Name: | N'-(2-bromobenzoyl)-3-nitro-4-{[(oxolan-2-yl)methyl]sulfanyl}benzohydrazide |
| Molecular Weight: | 480.34 |
| Molecular Formula: | C19 H18 Br N3 O5 S |
| Smiles: | C1CC(CSc2ccc(cc2[N+]([O-])=O)C(NNC(c2ccccc2[Br])=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3359 |
| logD: | 3.1104 |
| logSw: | -3.9986 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.898 |
| InChI Key: | QPMJRHKZEATWSY-CYBMUJFWSA-N |