6-nitro-4-(phenylsulfanyl)-1,2-benzothiazole
Chemical Structure Depiction of
6-nitro-4-(phenylsulfanyl)-1,2-benzothiazole
6-nitro-4-(phenylsulfanyl)-1,2-benzothiazole
Compound characteristics
| Compound ID: | 8019-6368 |
| Compound Name: | 6-nitro-4-(phenylsulfanyl)-1,2-benzothiazole |
| Molecular Weight: | 288.34 |
| Molecular Formula: | C13 H8 N2 O2 S2 |
| Smiles: | c1ccc(cc1)Sc1cc(cc2c1cns2)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.095 |
| logD: | 4.095 |
| logSw: | -4.2958 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.649 |
| InChI Key: | PTKLQFPBIHBSGI-UHFFFAOYSA-N |