(2,3-dimethylphenyl){4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
(2,3-dimethylphenyl){4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}methanone--hydrogen chloride (1/1)
(2,3-dimethylphenyl){4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | J075-3391 |
| Compound Name: | (2,3-dimethylphenyl){4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 426.95 |
| Molecular Formula: | C23 H26 N4 O2 |
| Salt: | HCl |
| Smiles: | Cc1cccc(C(N2CCCN(CC2)Cc2nc(c3ccccc3)on2)=O)c1C |
| Stereo: | ACHIRAL |
| logP: | 3.6556 |
| logD: | 3.6556 |
| logSw: | -3.7609 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.426 |
| InChI Key: | CXFAEAWAWODRDM-UHFFFAOYSA-N |