7-(1-acetylpiperidin-4-yl)-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-(1-acetylpiperidin-4-yl)-2-methyl-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one
7-(1-acetylpiperidin-4-yl)-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: | S636-0988 |
| Compound Name: | 7-(1-acetylpiperidin-4-yl)-2-methyl-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one |
| Molecular Weight: | 293.37 |
| Molecular Formula: | C14 H23 N5 O2 |
| Smiles: | CC(N1CCC(CC1)N1CCC2=NN(C)C(N2CC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2868 |
| logD: | -2.7007 |
| logSw: | -0.3888 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.756 |
| InChI Key: | LAFYTWUGXDQELR-UHFFFAOYSA-N |