1-(adamantan-1-yl)-4-(2,5-dimethoxybenzene-1-sulfonyl)piperazine
Chemical Structure Depiction of
1-(adamantan-1-yl)-4-(2,5-dimethoxybenzene-1-sulfonyl)piperazine
1-(adamantan-1-yl)-4-(2,5-dimethoxybenzene-1-sulfonyl)piperazine
Compound characteristics
Compound ID: | 8012-7970 |
Compound Name: | 1-(adamantan-1-yl)-4-(2,5-dimethoxybenzene-1-sulfonyl)piperazine |
Molecular Weight: | 420.57 |
Molecular Formula: | C22 H32 N2 O4 S |
Smiles: | COc1ccc(c(c1)S(N1CCN(CC1)C12CC3CC(CC(C3)C2)C1)(=O)=O)OC |
Stereo: | ACHIRAL |
logP: | 4.0859 |
logD: | 4.0676 |
logSw: | -4.3415 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 50.076 |
InChI Key: | RRUHRQCUOJRTHJ-UHFFFAOYSA-N |