ethyl 1-{[7-(azepan-1-yl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{[7-(azepan-1-yl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methyl}piperidine-3-carboxylate
ethyl 1-{[7-(azepan-1-yl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methyl}piperidine-3-carboxylate
Compound characteristics
Compound ID: | P659-2619 |
Compound Name: | ethyl 1-{[7-(azepan-1-yl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methyl}piperidine-3-carboxylate |
Molecular Weight: | 400.52 |
Molecular Formula: | C21 H32 N6 O2 |
Smiles: | CCOC(C1CCCN(C1)Cc1nc2nc(C)cc(N3CCCCCC3)n2n1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.8542 |
logD: | 2.7852 |
logSw: | -2.8074 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 59.13 |
InChI Key: | FPTBWQBXZOGNDB-KRWDZBQOSA-N |