4-phenyl-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]butan-1-one
Chemical Structure Depiction of
4-phenyl-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]butan-1-one
4-phenyl-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]butan-1-one
Compound characteristics
| Compound ID: | T404-0851 |
| Compound Name: | 4-phenyl-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]butan-1-one |
| Molecular Weight: | 363.46 |
| Molecular Formula: | C21 H25 N5 O |
| Smiles: | C(CC(N1CCCN(CC1)c1nnc2ccccn12)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8631 |
| logD: | 2.863 |
| logSw: | -3.137 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.102 |
| InChI Key: | FQQGVTMCNPPLPR-UHFFFAOYSA-N |