3-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
3-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K277-0020 |
| Compound Name: | 3-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 350.35 |
| Molecular Formula: | C18 H10 N2 O4 S |
| Smiles: | C1=C(C(=O)Oc2ccccc12)c1nc(cs1)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7104 |
| logD: | 4.7104 |
| logSw: | -5.0518 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.004 |
| InChI Key: | PZSKLBMJWNFECG-UHFFFAOYSA-N |