3-ethoxy-1-{4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}propan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-ethoxy-1-{4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}propan-1-one--hydrogen chloride (1/1)
3-ethoxy-1-{4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}propan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | J075-3721 |
| Compound Name: | 3-ethoxy-1-{4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}propan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 394.9 |
| Molecular Formula: | C19 H26 N4 O3 |
| Salt: | HCl |
| Smiles: | CCOCCC(N1CCCN(CC1)Cc1nc(c2ccccc2)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6127 |
| logD: | 1.6126 |
| logSw: | -1.9592 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.148 |
| InChI Key: | TXGXWUOQHUMARF-UHFFFAOYSA-N |