N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl}-4-fluorobenzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl}-4-fluorobenzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl}-4-fluorobenzamide
Compound characteristics
| Compound ID: | V003-0938 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl}-4-fluorobenzamide |
| Molecular Weight: | 458.49 |
| Molecular Formula: | C27 H23 F N2 O4 |
| Smiles: | Cc1ccc(C)c(c1)c1cc(CN(Cc2ccc3c(c2)OCO3)C(c2ccc(cc2)F)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.4234 |
| logD: | 5.4234 |
| logSw: | -5.4172 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.324 |
| InChI Key: | XFRHIJLGLDQJIR-UHFFFAOYSA-N |