1-{[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]methyl}-4-(5-chloro-2-methylphenyl)piperazine
Chemical Structure Depiction of
1-{[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]methyl}-4-(5-chloro-2-methylphenyl)piperazine
1-{[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]methyl}-4-(5-chloro-2-methylphenyl)piperazine
Compound characteristics
| Compound ID: | C301-4245 |
| Compound Name: | 1-{[5-(2H-1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]methyl}-4-(5-chloro-2-methylphenyl)piperazine |
| Molecular Weight: | 412.87 |
| Molecular Formula: | C21 H21 Cl N4 O3 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)Cc1nnc(c2ccc3c(c2)OCO3)o1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.0076 |
| logD: | 4.0071 |
| logSw: | -4.4174 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.227 |
| InChI Key: | KULUHOOSGCNFFA-UHFFFAOYSA-N |