7-(azepan-1-yl)-3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
7-(azepan-1-yl)-3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidine
7-(azepan-1-yl)-3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
Compound ID: | 8015-3090 |
Compound Name: | 7-(azepan-1-yl)-3-benzyl-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
Molecular Weight: | 308.38 |
Molecular Formula: | C17 H20 N6 |
Smiles: | C1CCCN(CC1)c1c2c(ncn1)n(Cc1ccccc1)nn2 |
Stereo: | ACHIRAL |
logP: | 3.2326 |
logD: | 3.2325 |
logSw: | -3.0562 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 50.82 |
InChI Key: | DMVHTWWJETVRRL-UHFFFAOYSA-N |