4-[(4-chloro-2-methylanilino)methylidene]-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(4-chloro-2-methylanilino)methylidene]-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
4-[(4-chloro-2-methylanilino)methylidene]-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-0279 |
| Compound Name: | 4-[(4-chloro-2-methylanilino)methylidene]-2-(3,4,5-trimethoxyphenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 402.83 |
| Molecular Formula: | C20 H19 Cl N2 O5 |
| Smiles: | Cc1cc(ccc1N/C=C1/C(=O)OC(c2cc(c(c(c2)OC)OC)OC)=N1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.8275 |
| logD: | 3.8253 |
| logSw: | -4.4399 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.257 |
| InChI Key: | BPNYZLLHVDMOPV-UHFFFAOYSA-N |