4-(4-{[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazine-1-carbonyl)benzonitrile
Chemical Structure Depiction of
4-(4-{[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazine-1-carbonyl)benzonitrile
4-(4-{[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazine-1-carbonyl)benzonitrile
Compound characteristics
| Compound ID: | D676-5074 |
| Compound Name: | 4-(4-{[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]methyl}piperazine-1-carbonyl)benzonitrile |
| Molecular Weight: | 407.86 |
| Molecular Formula: | C21 H18 Cl N5 O2 |
| Smiles: | C1CN(CCN1Cc1nc(c2cccc(c2)[Cl])on1)C(c1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7218 |
| logD: | 2.7218 |
| logSw: | -3.4336 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 70.151 |
| InChI Key: | SYQUIEBDDZCGPR-UHFFFAOYSA-N |