2-chloro-5-nitro-N-[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]benzamide
Chemical Structure Depiction of
2-chloro-5-nitro-N-[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]benzamide
2-chloro-5-nitro-N-[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]benzamide
Compound characteristics
| Compound ID: | 2154-0348 |
| Compound Name: | 2-chloro-5-nitro-N-[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]benzamide |
| Molecular Weight: | 420.81 |
| Molecular Formula: | C22 H13 Cl N2 O5 |
| Smiles: | C1=C(C(=O)Oc2ccccc12)c1ccc(cc1)NC(c1cc(ccc1[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6134 |
| logD: | 4.5446 |
| logSw: | -4.901 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.361 |
| InChI Key: | AUYVNLDLRNRFDD-UHFFFAOYSA-N |