1-[4-(6-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]-2-methylpropan-1-one
Chemical Structure Depiction of
1-[4-(6-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]-2-methylpropan-1-one
1-[4-(6-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]-2-methylpropan-1-one
Compound characteristics
| Compound ID: | T404-1075 |
| Compound Name: | 1-[4-(6-chloro[1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]-2-methylpropan-1-one |
| Molecular Weight: | 321.81 |
| Molecular Formula: | C15 H20 Cl N5 O |
| Smiles: | CC(C)C(N1CCCN(CC1)c1nnc2ccc(cn12)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3272 |
| logD: | 2.3272 |
| logSw: | -2.8521 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.794 |
| InChI Key: | XBVJSZVWGSCZKH-UHFFFAOYSA-N |