N-[4-(1,3-benzothiazol-2-yl)phenyl]-5-nitrofuran-2-carboxamide
Chemical Structure Depiction of
N-[4-(1,3-benzothiazol-2-yl)phenyl]-5-nitrofuran-2-carboxamide
N-[4-(1,3-benzothiazol-2-yl)phenyl]-5-nitrofuran-2-carboxamide
Compound characteristics
| Compound ID: | 2005-0050 |
| Compound Name: | N-[4-(1,3-benzothiazol-2-yl)phenyl]-5-nitrofuran-2-carboxamide |
| Molecular Weight: | 365.37 |
| Molecular Formula: | C18 H11 N3 O4 S |
| Smiles: | c1ccc2c(c1)nc(c1ccc(cc1)NC(c1ccc([N+]([O-])=O)o1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.2596 |
| logD: | 4.2594 |
| logSw: | -4.5952 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.439 |
| InChI Key: | HJEWXDDOPNSHGH-UHFFFAOYSA-N |