7-(6-methoxypyridine-3-carbonyl)-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-methoxypyridine-3-carbonyl)-2-methyl-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one
7-(6-methoxypyridine-3-carbonyl)-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: | S636-0640 |
| Compound Name: | 7-(6-methoxypyridine-3-carbonyl)-2-methyl-2,5,6,7,8,9-hexahydro-3H-[1,2,4]triazolo[4,3-d][1,4]diazepin-3-one |
| Molecular Weight: | 303.32 |
| Molecular Formula: | C14 H17 N5 O3 |
| Smiles: | CN1C(N2CCN(CCC2=N1)C(c1ccc(nc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3157 |
| logD: | 0.3157 |
| logSw: | -1.0612 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.504 |
| InChI Key: | WGCXQFWVMVITOK-UHFFFAOYSA-N |