2-(2-chloro-4-nitrophenyl)-4-(2-methyl-3-phenylprop-2-en-1-ylidene)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(2-chloro-4-nitrophenyl)-4-(2-methyl-3-phenylprop-2-en-1-ylidene)-1,3-oxazol-5(4H)-one
2-(2-chloro-4-nitrophenyl)-4-(2-methyl-3-phenylprop-2-en-1-ylidene)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-0231 |
| Compound Name: | 2-(2-chloro-4-nitrophenyl)-4-(2-methyl-3-phenylprop-2-en-1-ylidene)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 368.77 |
| Molecular Formula: | C19 H13 Cl N2 O4 |
| Smiles: | C/C(=C\c1ccccc1)/C=C1/C(=O)OC(c2ccc(cc2[Cl])[N+]([O-])=O)=N1 |
| Stereo: | ACHIRAL |
| logP: | 4.782 |
| logD: | 4.782 |
| logSw: | -5.119 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.757 |
| InChI Key: | CCFBGHOSCDKUQG-UHFFFAOYSA-N |