N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-N-{[5-(2,5-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-N-{[5-(2,5-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-N-{[5-(2,5-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}benzamide
Compound characteristics
| Compound ID: | V005-4820 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-N-{[5-(2,5-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}benzamide |
| Molecular Weight: | 506.94 |
| Molecular Formula: | C27 H23 Cl N2 O6 |
| Smiles: | COc1ccc(c(c1)c1cc(CN(Cc2ccc3c(c2)OCO3)C(c2ccccc2[Cl])=O)no1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.911 |
| logD: | 4.911 |
| logSw: | -4.9428 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.498 |
| InChI Key: | NJZKGASHOOWYEH-UHFFFAOYSA-N |