N-benzyl-4-{3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl}-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
N-benzyl-4-{3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl}-1,4-diazepane-1-carboxamide
N-benzyl-4-{3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl}-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | P891-4092 |
| Compound Name: | N-benzyl-4-{3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl}-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C23 H28 N6 O2 |
| Smiles: | CC(C)c1nc(c2cccnc2N2CCCN(CC2)C(NCc2ccccc2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.6349 |
| logD: | 3.4091 |
| logSw: | -3.7698 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.279 |
| InChI Key: | PQXJMHXZBUEBET-UHFFFAOYSA-N |