2-(4-methylphenyl)-1-(4-{3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl}-1,4-diazepan-1-yl)ethan-1-one
Chemical Structure Depiction of
2-(4-methylphenyl)-1-(4-{3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl}-1,4-diazepan-1-yl)ethan-1-one
2-(4-methylphenyl)-1-(4-{3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl}-1,4-diazepan-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | P891-1627 |
| Compound Name: | 2-(4-methylphenyl)-1-(4-{3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl}-1,4-diazepan-1-yl)ethan-1-one |
| Molecular Weight: | 419.53 |
| Molecular Formula: | C24 H29 N5 O2 |
| Smiles: | CC(C)c1nc(c2cccnc2N2CCCN(CC2)C(Cc2ccc(C)cc2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.3497 |
| logD: | 4.1239 |
| logSw: | -4.3133 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.609 |
| InChI Key: | ZKAKNBCHFSSMFS-UHFFFAOYSA-N |