N-[rel-(3R,4R)-1'-acetyl-4-(3-methyl-1H-1,2,4-triazol-5-yl)[1,4'-bipiperidin]-3-yl]-2-methoxyacetamide
Chemical Structure Depiction of
N-[rel-(3R,4R)-1'-acetyl-4-(3-methyl-1H-1,2,4-triazol-5-yl)[1,4'-bipiperidin]-3-yl]-2-methoxyacetamide
N-[rel-(3R,4R)-1'-acetyl-4-(3-methyl-1H-1,2,4-triazol-5-yl)[1,4'-bipiperidin]-3-yl]-2-methoxyacetamide
Compound characteristics
| Compound ID: | S620-1472 |
| Compound Name: | N-[rel-(3R,4R)-1'-acetyl-4-(3-methyl-1H-1,2,4-triazol-5-yl)[1,4'-bipiperidin]-3-yl]-2-methoxyacetamide |
| Molecular Weight: | 378.47 |
| Molecular Formula: | C18 H30 N6 O3 |
| Smiles: | CC(N1CCC(CC1)N1CC[C@H](c2nc(C)n[nH]2)[C@@H](C1)NC(COC)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.6251 |
| logD: | -2.5196 |
| logSw: | -1.4322 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.869 |
| InChI Key: | LKYXFMWQCKUCTF-CVEARBPZSA-N |