7-[(6-methoxypyridin-2-yl)methyl]-2-methyl-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one
Chemical Structure Depiction of
7-[(6-methoxypyridin-2-yl)methyl]-2-methyl-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one
7-[(6-methoxypyridin-2-yl)methyl]-2-methyl-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one
Compound characteristics
| Compound ID: | S636-0854 |
| Compound Name: | 7-[(6-methoxypyridin-2-yl)methyl]-2-methyl-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one |
| Molecular Weight: | 289.33 |
| Molecular Formula: | C14 H19 N5 O2 |
| Smiles: | CN1C(N2CCN(CCC2=N1)Cc1cccc(n1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2172 |
| logD: | -0.5932 |
| logSw: | -1.6075 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.562 |
| InChI Key: | MPLWKOJTLYUGRA-UHFFFAOYSA-N |