2-[2-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-4-yl]-3H-naphtho[2,1-b]pyran-3-one
Chemical Structure Depiction of
2-[2-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-4-yl]-3H-naphtho[2,1-b]pyran-3-one
2-[2-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-4-yl]-3H-naphtho[2,1-b]pyran-3-one
Compound characteristics
| Compound ID: | 1246-0843 |
| Compound Name: | 2-[2-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)-1,3-thiazol-4-yl]-3H-naphtho[2,1-b]pyran-3-one |
| Molecular Weight: | 468.44 |
| Molecular Formula: | C25 H12 N2 O6 S |
| Smiles: | C1=C(C(=O)Oc2ccc(cc12)[N+]([O-])=O)c1nc(cs1)C1=Cc2c(ccc3ccccc23)OC1=O |
| Stereo: | ACHIRAL |
| logP: | 5.3218 |
| logD: | 5.3218 |
| logSw: | -6.7282 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.654 |
| InChI Key: | OUOPRVAKULXATP-UHFFFAOYSA-N |