2-(4-chlorophenyl)-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]ethan-1-one
2-(4-chlorophenyl)-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | T404-0807 |
| Compound Name: | 2-(4-chlorophenyl)-1-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 369.85 |
| Molecular Formula: | C19 H20 Cl N5 O |
| Smiles: | C1CN(CCN(C1)c1nnc2ccccn12)C(Cc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.568 |
| logD: | 2.568 |
| logSw: | -2.8799 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.102 |
| InChI Key: | ZGISULXAODESGE-UHFFFAOYSA-N |