N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-(6-nitro-2H-1,3-benzodioxol-5-yl)methanimine
Chemical Structure Depiction of
N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-(6-nitro-2H-1,3-benzodioxol-5-yl)methanimine
N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-(6-nitro-2H-1,3-benzodioxol-5-yl)methanimine
Compound characteristics
| Compound ID: | 8005-4499 |
| Compound Name: | N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-(6-nitro-2H-1,3-benzodioxol-5-yl)methanimine |
| Molecular Weight: | 417.44 |
| Molecular Formula: | C22 H15 N3 O4 S |
| Smiles: | Cc1ccc2c(c1)sc(c1ccc(cc1)/N=C/c1cc3c(cc1[N+]([O-])=O)OCO3)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.5253 |
| logD: | 5.5249 |
| logSw: | -5.4358 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.011 |
| InChI Key: | XGFYWJZXPNESRE-UHFFFAOYSA-N |