2-(4-methyl-3-nitrophenyl)-4-({3-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-methyl-3-nitrophenyl)-4-({3-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-1,3-oxazol-5(4H)-one
2-(4-methyl-3-nitrophenyl)-4-({3-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | Y508-0740 |
| Compound Name: | 2-(4-methyl-3-nitrophenyl)-4-({3-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 364.36 |
| Molecular Formula: | C20 H16 N2 O5 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C1=NC(=C/c2cccc(c2)OCC=C)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.1281 |
| logD: | 4.1281 |
| logSw: | -4.4655 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.874 |
| InChI Key: | VCDFVAHLQRTGBQ-UHFFFAOYSA-N |