2-(2-chloro-4-nitrophenyl)-4-(2-chloro-3-phenylprop-2-en-1-ylidene)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(2-chloro-4-nitrophenyl)-4-(2-chloro-3-phenylprop-2-en-1-ylidene)-1,3-oxazol-5(4H)-one
2-(2-chloro-4-nitrophenyl)-4-(2-chloro-3-phenylprop-2-en-1-ylidene)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K088-0243 |
| Compound Name: | 2-(2-chloro-4-nitrophenyl)-4-(2-chloro-3-phenylprop-2-en-1-ylidene)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 389.19 |
| Molecular Formula: | C18 H10 Cl2 N2 O4 |
| Smiles: | C(=C1/C(=O)OC(c2ccc(cc2[Cl])[N+]([O-])=O)=N1)\C(=C/c1ccccc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7371 |
| logD: | 4.7371 |
| logSw: | -5.2044 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.757 |
| InChI Key: | MSIZTLGKWDKBIG-UHFFFAOYSA-N |