(4-ethylphenyl)[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]methanone
Chemical Structure Depiction of
(4-ethylphenyl)[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]methanone
(4-ethylphenyl)[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]methanone
Compound characteristics
| Compound ID: | T404-0783 |
| Compound Name: | (4-ethylphenyl)[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)-1,4-diazepan-1-yl]methanone |
| Molecular Weight: | 349.43 |
| Molecular Formula: | C20 H23 N5 O |
| Smiles: | CCc1ccc(cc1)C(N1CCCN(CC1)c1nnc2ccccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6247 |
| logD: | 2.6247 |
| logSw: | -2.6201 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.629 |
| InChI Key: | MCQVCYSHWOLSGZ-UHFFFAOYSA-N |