2-(4-butoxyphenyl)-4-{[(pyridin-3-yl)amino]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-butoxyphenyl)-4-{[(pyridin-3-yl)amino]methylidene}-1,3-oxazol-5(4H)-one
2-(4-butoxyphenyl)-4-{[(pyridin-3-yl)amino]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | K091-1012 |
| Compound Name: | 2-(4-butoxyphenyl)-4-{[(pyridin-3-yl)amino]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 337.38 |
| Molecular Formula: | C19 H19 N3 O3 |
| Smiles: | CCCCOc1ccc(cc1)C1=NC(=C/Nc2cccnc2)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 3.294 |
| logD: | 3.2939 |
| logSw: | -3.3118 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.912 |
| InChI Key: | WBDHMDJAICOZDP-UHFFFAOYSA-N |