1-(adamantan-1-yl)-4-(3,4-dichloro-2-methoxybenzene-1-sulfonyl)piperazine
Chemical Structure Depiction of
1-(adamantan-1-yl)-4-(3,4-dichloro-2-methoxybenzene-1-sulfonyl)piperazine
1-(adamantan-1-yl)-4-(3,4-dichloro-2-methoxybenzene-1-sulfonyl)piperazine
Compound characteristics
| Compound ID: | 8012-7972 |
| Compound Name: | 1-(adamantan-1-yl)-4-(3,4-dichloro-2-methoxybenzene-1-sulfonyl)piperazine |
| Molecular Weight: | 459.43 |
| Molecular Formula: | C21 H28 Cl2 N2 O3 S |
| Smiles: | COc1c(ccc(c1[Cl])[Cl])S(N1CCN(CC1)C12CC3CC(CC(C3)C2)C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4037 |
| logD: | 5.3854 |
| logSw: | -5.9803 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.618 |
| InChI Key: | CEDDWCCWBYMPIG-UHFFFAOYSA-N |