1-(3-chloro-4-methylphenyl)-4-{6-[4-(2-methylbutan-2-yl)phenoxy]hexyl}piperazine--methanesulfonic acid (1/1)
Chemical Structure Depiction of
1-(3-chloro-4-methylphenyl)-4-{6-[4-(2-methylbutan-2-yl)phenoxy]hexyl}piperazine--methanesulfonic acid (1/1)
1-(3-chloro-4-methylphenyl)-4-{6-[4-(2-methylbutan-2-yl)phenoxy]hexyl}piperazine--methanesulfonic acid (1/1)
Compound characteristics
| Compound ID: | 4048-0266 |
| Compound Name: | 1-(3-chloro-4-methylphenyl)-4-{6-[4-(2-methylbutan-2-yl)phenoxy]hexyl}piperazine--methanesulfonic acid (1/1) |
| Molecular Weight: | 553.21 |
| Molecular Formula: | C28 H41 Cl N2 O |
| Salt: | CH3SO3H |
| Smiles: | CCC(C)(C)c1ccc(cc1)OCCCCCCN1CCN(CC1)c1ccc(C)c(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 8.2124 |
| logD: | 7.8467 |
| logSw: | -6.7169 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 14.6274 |
| InChI Key: | LRQIJOWDNRNLDY-UHFFFAOYSA-N |