2-chloro-5-nitro-N-[4-(3-phenyladamantan-1-yl)phenyl]benzamide
Chemical Structure Depiction of
2-chloro-5-nitro-N-[4-(3-phenyladamantan-1-yl)phenyl]benzamide
2-chloro-5-nitro-N-[4-(3-phenyladamantan-1-yl)phenyl]benzamide
Compound characteristics
| Compound ID: | 0573-2137 |
| Compound Name: | 2-chloro-5-nitro-N-[4-(3-phenyladamantan-1-yl)phenyl]benzamide |
| Molecular Weight: | 487 |
| Molecular Formula: | C29 H27 Cl N2 O3 |
| Smiles: | C1C2CC3(CC1CC(C2)(C3)c1ccc(cc1)NC(c1cc(ccc1[Cl])[N+]([O-])=O)=O)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 8.1823 |
| logD: | 8.1718 |
| logSw: | -6.6893 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.201 |
| InChI Key: | DERRVEZGTJHGNO-UHFFFAOYSA-N |