N-[4-(adamantan-1-yl)phenyl]-2-chloro-5-nitrobenzamide
Chemical Structure Depiction of
N-[4-(adamantan-1-yl)phenyl]-2-chloro-5-nitrobenzamide
N-[4-(adamantan-1-yl)phenyl]-2-chloro-5-nitrobenzamide
Compound characteristics
| Compound ID: | 0335-0862 |
| Compound Name: | N-[4-(adamantan-1-yl)phenyl]-2-chloro-5-nitrobenzamide |
| Molecular Weight: | 410.9 |
| Molecular Formula: | C23 H23 Cl N2 O3 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)c1ccc(cc1)NC(c1cc(ccc1[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7195 |
| logD: | 6.7091 |
| logSw: | -6.5994 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.473 |
| InChI Key: | VHKMLGBIKCLIJQ-UHFFFAOYSA-N |