3-methyl-4-({5-[3-nitro-4-(piperidin-1-yl)phenyl]furan-2-yl}methylidene)-1,2-oxazol-5(4H)-one
Chemical Structure Depiction of
3-methyl-4-({5-[3-nitro-4-(piperidin-1-yl)phenyl]furan-2-yl}methylidene)-1,2-oxazol-5(4H)-one
3-methyl-4-({5-[3-nitro-4-(piperidin-1-yl)phenyl]furan-2-yl}methylidene)-1,2-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 4838-0156 |
| Compound Name: | 3-methyl-4-({5-[3-nitro-4-(piperidin-1-yl)phenyl]furan-2-yl}methylidene)-1,2-oxazol-5(4H)-one |
| Molecular Weight: | 381.39 |
| Molecular Formula: | C20 H19 N3 O5 |
| Smiles: | CC1/C(=C/c2ccc(c3ccc(c(c3)[N+]([O-])=O)N3CCCCC3)o2)C(=O)ON=1 |
| Stereo: | ACHIRAL |
| logP: | 3.8873 |
| logD: | 3.8873 |
| logSw: | -4.0202 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.938 |
| InChI Key: | FZNDTWCKMOFCPP-UHFFFAOYSA-N |