N-[1-(adamantan-1-yl)-2-(dimethylamino)-2-oxoethyl]-4-nitrobenzamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)-2-(dimethylamino)-2-oxoethyl]-4-nitrobenzamide
N-[1-(adamantan-1-yl)-2-(dimethylamino)-2-oxoethyl]-4-nitrobenzamide
Compound characteristics
| Compound ID: | 1189-0816 |
| Compound Name: | N-[1-(adamantan-1-yl)-2-(dimethylamino)-2-oxoethyl]-4-nitrobenzamide |
| Molecular Weight: | 385.46 |
| Molecular Formula: | C21 H27 N3 O4 |
| Smiles: | CN(C)C(C(C12CC3CC(CC(C3)C2)C1)NC(c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7996 |
| logD: | 2.7994 |
| logSw: | -3.3642 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.419 |
| InChI Key: | TUDUFOWEUWAVRR-YXSDIZSPSA-N |