1-[{1-[1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-yl]-1H-tetrazol-5-yl}(phenyl)methyl]piperidine
Chemical Structure Depiction of
1-[{1-[1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-yl]-1H-tetrazol-5-yl}(phenyl)methyl]piperidine
1-[{1-[1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-yl]-1H-tetrazol-5-yl}(phenyl)methyl]piperidine
Compound characteristics
| Compound ID: | 8006-2842 |
| Compound Name: | 1-[{1-[1-(4-chlorophenoxy)-3,3-dimethyl-1-(1H-1,2,4-triazol-1-yl)butan-2-yl]-1H-tetrazol-5-yl}(phenyl)methyl]piperidine |
| Molecular Weight: | 521.07 |
| Molecular Formula: | C27 H33 Cl N8 O |
| Smiles: | CC(C)(C)C(C(n1cncn1)Oc1ccc(cc1)[Cl])n1c(C(c2ccccc2)N2CCCCC2)nnn1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2843 |
| logD: | 4.78 |
| logSw: | -5.9197 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 72.119 |
| InChI Key: | FCSMPNCJPCLUFF-UHFFFAOYSA-N |