2-(4-butoxyphenyl)-4-[(5-chloro-2-methylanilino)methylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-butoxyphenyl)-4-[(5-chloro-2-methylanilino)methylidene]-1,3-oxazol-5(4H)-one
2-(4-butoxyphenyl)-4-[(5-chloro-2-methylanilino)methylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-1002 |
| Compound Name: | 2-(4-butoxyphenyl)-4-[(5-chloro-2-methylanilino)methylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 384.86 |
| Molecular Formula: | C21 H21 Cl N2 O3 |
| Smiles: | CCCCOc1ccc(cc1)C1=NC(=C/Nc2cc(ccc2C)[Cl])\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 5.3022 |
| logD: | 5.2995 |
| logSw: | -5.8339 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.696 |
| InChI Key: | UOAUBQRNKQNBKR-UHFFFAOYSA-N |