N-tert-butyl-3-[(5-nitrofuran-2-carbonyl)amino]-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-tert-butyl-3-[(5-nitrofuran-2-carbonyl)amino]-1-benzofuran-2-carboxamide
N-tert-butyl-3-[(5-nitrofuran-2-carbonyl)amino]-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | E957-1034 |
| Compound Name: | N-tert-butyl-3-[(5-nitrofuran-2-carbonyl)amino]-1-benzofuran-2-carboxamide |
| Molecular Weight: | 371.35 |
| Molecular Formula: | C18 H17 N3 O6 |
| Smiles: | CC(C)(C)NC(c1c(c2ccccc2o1)NC(c1ccc([N+]([O-])=O)o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8863 |
| logD: | 2.2316 |
| logSw: | -3.3206 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.629 |
| InChI Key: | YCAQDRCNAAYUFQ-UHFFFAOYSA-N |