2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-N-[(oxolan-2-yl)methyl]acetamide
2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | 8005-1587 |
| Compound Name: | 2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 353.42 |
| Molecular Formula: | C14 H15 N3 O4 S2 |
| Smiles: | C1CC(CNC(CSc2nc3ccc(cc3s2)[N+]([O-])=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2289 |
| logD: | 2.2289 |
| logSw: | -2.8312 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.556 |
| InChI Key: | DIQRRRASKWSQRT-SNVBAGLBSA-N |