2-(4-nitrophenyl)-4-{[(1,3-thiazol-2-yl)amino]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-nitrophenyl)-4-{[(1,3-thiazol-2-yl)amino]methylidene}-1,3-oxazol-5(4H)-one
2-(4-nitrophenyl)-4-{[(1,3-thiazol-2-yl)amino]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-0178 |
| Compound Name: | 2-(4-nitrophenyl)-4-{[(1,3-thiazol-2-yl)amino]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 316.29 |
| Molecular Formula: | C13 H8 N4 O4 S |
| Smiles: | C(=C1/C(=O)OC(c2ccc(cc2)[N+]([O-])=O)=N1)/Nc1nccs1 |
| Stereo: | ACHIRAL |
| logP: | 2.0856 |
| logD: | 2.0795 |
| logSw: | -2.7975 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.837 |
| InChI Key: | GLAOMAIUFYMJKW-UHFFFAOYSA-N |