3-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-(3-ethoxyphenyl)-6-nitro-2H-1-benzopyran-2-imine
Chemical Structure Depiction of
3-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-(3-ethoxyphenyl)-6-nitro-2H-1-benzopyran-2-imine
3-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-(3-ethoxyphenyl)-6-nitro-2H-1-benzopyran-2-imine
Compound characteristics
| Compound ID: | K276-0056 |
| Compound Name: | 3-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-(3-ethoxyphenyl)-6-nitro-2H-1-benzopyran-2-imine |
| Molecular Weight: | 503.96 |
| Molecular Formula: | C26 H18 Cl N3 O4 S |
| Smiles: | CCOc1cccc(c1)/N=C1/C(=Cc2cc(ccc2O1)[N+]([O-])=O)c1nc(cs1)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.626 |
| logD: | 7.5174 |
| logSw: | -6.6474 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.912 |
| InChI Key: | GIWJXDZQEZATON-UHFFFAOYSA-N |