(3,4-difluorophenyl){4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}methanone--hydrogen chloride (1/1)
Chemical Structure Depiction of
(3,4-difluorophenyl){4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}methanone--hydrogen chloride (1/1)
(3,4-difluorophenyl){4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}methanone--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | J075-4228 |
| Compound Name: | (3,4-difluorophenyl){4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl}methanone--hydrogen chloride (1/1) |
| Molecular Weight: | 434.87 |
| Molecular Formula: | C21 H20 F2 N4 O2 |
| Salt: | HCl |
| Smiles: | C1CN(CCN(C1)C(c1ccc(c(c1)F)F)=O)Cc1nc(c2ccccc2)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.9462 |
| logD: | 2.9462 |
| logSw: | -3.2512 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.426 |
| InChI Key: | LCEOTPJHPKZHJH-UHFFFAOYSA-N |