N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-5-nitrofuran-2-carboxamide
Chemical Structure Depiction of
N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-5-nitrofuran-2-carboxamide
N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-5-nitrofuran-2-carboxamide
Compound characteristics
| Compound ID: | 2081-1767 |
| Compound Name: | N-[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-5-nitrofuran-2-carboxamide |
| Molecular Weight: | 377.35 |
| Molecular Formula: | C20 H15 N3 O5 |
| Smiles: | Cc1cc2c(cc1C)oc(c1ccc(cc1)NC(c1ccc([N+]([O-])=O)o1)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.5527 |
| logD: | 4.5525 |
| logSw: | -4.4485 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.8 |
| InChI Key: | YPKKWBFKIBXBKY-UHFFFAOYSA-N |