[rel-(5R,7S)-3-(5-methyl-2H-tetrazol-2-yl)adamantan-1-yl](4-phenylpiperazin-1-yl)methanone
Chemical Structure Depiction of
[rel-(5R,7S)-3-(5-methyl-2H-tetrazol-2-yl)adamantan-1-yl](4-phenylpiperazin-1-yl)methanone
[rel-(5R,7S)-3-(5-methyl-2H-tetrazol-2-yl)adamantan-1-yl](4-phenylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | C301-1225 |
| Compound Name: | [rel-(5R,7S)-3-(5-methyl-2H-tetrazol-2-yl)adamantan-1-yl](4-phenylpiperazin-1-yl)methanone |
| Molecular Weight: | 406.53 |
| Molecular Formula: | C23 H30 N6 O |
| Smiles: | [H][C@]12CC3(CC(C1)(C[C@@]([H])(C3)C2)n1nc(C)nn1)C(N1CCN(CC1)c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3909 |
| logD: | 3.3908 |
| logSw: | -3.5342 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 57.356 |
| InChI Key: | AAMIERAAHIMJMI-WSUXWNOTSA-N |