N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide
Chemical Structure Depiction of
N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide
N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide
Compound characteristics
| Compound ID: | Y031-7755 |
| Compound Name: | N-(1,3-benzothiazol-2-yl)-5-nitrofuran-2-carboxamide |
| Molecular Weight: | 289.27 |
| Molecular Formula: | C12 H7 N3 O4 S |
| Smiles: | c1ccc2c(c1)nc(NC(c1ccc([N+]([O-])=O)o1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.1047 |
| logD: | 3.0929 |
| logSw: | -3.5237 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.751 |
| InChI Key: | INEMNYHCDSBKGP-UHFFFAOYSA-N |