N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]-1-(3-nitrophenyl)methanimine
Chemical Structure Depiction of
N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]-1-(3-nitrophenyl)methanimine
N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]-1-(3-nitrophenyl)methanimine
Compound characteristics
| Compound ID: | 8002-0783 |
| Compound Name: | N-[2-(methylsulfanyl)-1,3-benzothiazol-6-yl]-1-(3-nitrophenyl)methanimine |
| Molecular Weight: | 329.4 |
| Molecular Formula: | C15 H11 N3 O2 S2 |
| Smiles: | CSc1nc2ccc(cc2s1)/N=C/c1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.372 |
| logD: | 4.372 |
| logSw: | -4.5517 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.829 |
| InChI Key: | WLBLEQMUQVQENT-UHFFFAOYSA-N |