2-methyl-4-[2-(thiophen-2-yl)-4H-1-benzopyran-4-ylidene]-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-methyl-4-[2-(thiophen-2-yl)-4H-1-benzopyran-4-ylidene]-1,3-oxazol-5(4H)-one
2-methyl-4-[2-(thiophen-2-yl)-4H-1-benzopyran-4-ylidene]-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 7612-0009 |
| Compound Name: | 2-methyl-4-[2-(thiophen-2-yl)-4H-1-benzopyran-4-ylidene]-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 309.34 |
| Molecular Formula: | C17 H11 N O3 S |
| Smiles: | CC1=NC(=C2\C=C(c3cccs3)Oc3ccccc23)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 3.6355 |
| logD: | 3.6355 |
| logSw: | -4.0678 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.606 |
| InChI Key: | SHBJVDYOZJBURV-UHFFFAOYSA-N |