8-methoxy-3-[2-(4-nitrophenyl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-methoxy-3-[2-(4-nitrophenyl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
8-methoxy-3-[2-(4-nitrophenyl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K234-0067 |
| Compound Name: | 8-methoxy-3-[2-(4-nitrophenyl)-1,3-thiazol-4-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 380.38 |
| Molecular Formula: | C19 H12 N2 O5 S |
| Smiles: | COc1cccc2C=C(C(=O)Oc12)c1csc(c2ccc(cc2)[N+]([O-])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.4082 |
| logD: | 4.4082 |
| logSw: | -4.6459 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.319 |
| InChI Key: | SZVHRABLEXCOQY-UHFFFAOYSA-N |