7-(azepan-1-yl)-3-[(naphthalen-1-yl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Chemical Structure Depiction of
7-(azepan-1-yl)-3-[(naphthalen-1-yl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
7-(azepan-1-yl)-3-[(naphthalen-1-yl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Compound characteristics
| Compound ID: | 8016-9378 |
| Compound Name: | 7-(azepan-1-yl)-3-[(naphthalen-1-yl)methyl]-3H-[1,2,3]triazolo[4,5-d]pyrimidine |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C21 H22 N6 |
| Smiles: | C1CCCN(CC1)c1c2c(ncn1)n(Cc1cccc3ccccc13)nn2 |
| Stereo: | ACHIRAL |
| logP: | 4.4874 |
| logD: | 4.4872 |
| logSw: | -4.4782 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 50.549 |
| InChI Key: | MWSHHKTZEHFEDJ-UHFFFAOYSA-N |