4-[(4-butylanilino)methylidene]-2-(4-chlorophenyl)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
4-[(4-butylanilino)methylidene]-2-(4-chlorophenyl)-1,3-oxazol-5(4H)-one
4-[(4-butylanilino)methylidene]-2-(4-chlorophenyl)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2113-0053 |
| Compound Name: | 4-[(4-butylanilino)methylidene]-2-(4-chlorophenyl)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 354.83 |
| Molecular Formula: | C20 H19 Cl N2 O2 |
| Smiles: | CCCCc1ccc(cc1)N/C=C1/C(=O)OC(c2ccc(cc2)[Cl])=N1 |
| Stereo: | ACHIRAL |
| logP: | 5.606 |
| logD: | 5.6059 |
| logSw: | -5.9518 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.977 |
| InChI Key: | PAFBNSBPMAKJQF-UHFFFAOYSA-N |