3-[4-([1,1'-biphenyl]-4-yl)-1,3-thiazol-2-yl]-6-nitro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[4-([1,1'-biphenyl]-4-yl)-1,3-thiazol-2-yl]-6-nitro-2H-1-benzopyran-2-one
3-[4-([1,1'-biphenyl]-4-yl)-1,3-thiazol-2-yl]-6-nitro-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | 0833-0121 |
Compound Name: | 3-[4-([1,1'-biphenyl]-4-yl)-1,3-thiazol-2-yl]-6-nitro-2H-1-benzopyran-2-one |
Molecular Weight: | 426.45 |
Molecular Formula: | C24 H14 N2 O4 S |
Smiles: | C1=C(C(=O)Oc2ccc(cc12)[N+]([O-])=O)c1nc(cs1)c1ccc(cc1)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 6.4685 |
logD: | 6.4685 |
logSw: | -6.3543 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 63.732 |
InChI Key: | UYNAQTSNKCGWCM-UHFFFAOYSA-N |