2-(4-methyl-3-nitrophenyl)-4-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(4-methyl-3-nitrophenyl)-4-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-1,3-oxazol-5(4H)-one
2-(4-methyl-3-nitrophenyl)-4-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 2062-1217 |
| Compound Name: | 2-(4-methyl-3-nitrophenyl)-4-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 419.35 |
| Molecular Formula: | C21 H13 N3 O7 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C1=NC(=C/c2ccc(c3cccc(c3)[N+]([O-])=O)o2)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 4.8558 |
| logD: | 4.8558 |
| logSw: | -4.8008 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 104.408 |
| InChI Key: | XMXVNRHNYLSTNS-UHFFFAOYSA-N |