2-phenoxy-1-{4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}ethan-1-one
Chemical Structure Depiction of
2-phenoxy-1-{4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}ethan-1-one
2-phenoxy-1-{4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | J075-3736 |
| Compound Name: | 2-phenoxy-1-{4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}ethan-1-one |
| Molecular Weight: | 428.92 |
| Molecular Formula: | C22 H24 N4 O3 |
| Salt: | HCl |
| Smiles: | C1CN(CCN(C1)C(COc1ccccc1)=O)Cc1nc(c2ccccc2)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.4065 |
| logD: | 2.4064 |
| logSw: | -2.5136 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.398 |
| InChI Key: | CDOYOEXUIIFTOW-UHFFFAOYSA-N |