6-nitro-2H-1,4-benzothiazin-3(4H)-one
Chemical Structure Depiction of
6-nitro-2H-1,4-benzothiazin-3(4H)-one
6-nitro-2H-1,4-benzothiazin-3(4H)-one
Compound characteristics
| Compound ID: | 3601-0282 |
| Compound Name: | 6-nitro-2H-1,4-benzothiazin-3(4H)-one |
| Molecular Weight: | 210.21 |
| Molecular Formula: | C8 H6 N2 O3 S |
| Smiles: | C1C(Nc2cc(ccc2S1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3661 |
| logD: | 1.3661 |
| logSw: | -2.5626 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.441 |
| InChI Key: | BALSKAVZBPPKCS-UHFFFAOYSA-N |