N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-5-nitrofuran-2-carboxamide
Chemical Structure Depiction of
N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-5-nitrofuran-2-carboxamide
N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-5-nitrofuran-2-carboxamide
Compound characteristics
| Compound ID: | 2081-1770 |
| Compound Name: | N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-5-nitrofuran-2-carboxamide |
| Molecular Weight: | 391.38 |
| Molecular Formula: | C21 H17 N3 O5 |
| Smiles: | Cc1cc(C)c2c(c1)nc(c1cccc(c1C)NC(c1ccc([N+]([O-])=O)o1)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 4.7729 |
| logD: | 4.7727 |
| logSw: | -4.5165 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.336 |
| InChI Key: | KMZANNAQIQIXTQ-UHFFFAOYSA-N |