3-{2-[(3-chloro-4-methylphenyl)-N-methylcarbamamido]ethyl}-N-[(4-fluorophenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
3-{2-[(3-chloro-4-methylphenyl)-N-methylcarbamamido]ethyl}-N-[(4-fluorophenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
3-{2-[(3-chloro-4-methylphenyl)-N-methylcarbamamido]ethyl}-N-[(4-fluorophenyl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | L080-0150 |
| Compound Name: | 3-{2-[(3-chloro-4-methylphenyl)-N-methylcarbamamido]ethyl}-N-[(4-fluorophenyl)methyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 445.88 |
| Molecular Formula: | C21 H21 Cl F N5 O3 |
| Smiles: | Cc1ccc(cc1[Cl])NC(N(C)CCc1nc(C(NCc2ccc(cc2)F)=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8912 |
| logD: | 3.8911 |
| logSw: | -4.3201 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.541 |
| InChI Key: | OLEBIFAQHVGTCZ-UHFFFAOYSA-N |