4-methoxy-2-methyl-6-nitro-1,2-benzothiazol-3(2H)-one
Chemical Structure Depiction of
4-methoxy-2-methyl-6-nitro-1,2-benzothiazol-3(2H)-one
4-methoxy-2-methyl-6-nitro-1,2-benzothiazol-3(2H)-one
Compound characteristics
| Compound ID: | 8009-3688 |
| Compound Name: | 4-methoxy-2-methyl-6-nitro-1,2-benzothiazol-3(2H)-one |
| Molecular Weight: | 240.23 |
| Molecular Formula: | C9 H8 N2 O4 S |
| Smiles: | CN1C(c2c(cc(cc2S1)[N+]([O-])=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5773 |
| logD: | 1.5773 |
| logSw: | -2.0449 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.02 |
| InChI Key: | JOSDAIOGEHUKMX-UHFFFAOYSA-N |