N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[5-(2,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl}benzenesulfonamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[5-(2,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl}benzenesulfonamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[5-(2,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl}benzenesulfonamide
Compound characteristics
| Compound ID: | V005-2527 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[5-(2,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl}benzenesulfonamide |
| Molecular Weight: | 476.55 |
| Molecular Formula: | C26 H24 N2 O5 S |
| Smiles: | Cc1ccc(c(C)c1)c1cc(CN(Cc2ccc3c(c2)OCO3)S(c2ccccc2)(=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 5.7022 |
| logD: | 5.7022 |
| logSw: | -5.5574 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.488 |
| InChI Key: | RPOCIYLNOCPFTF-UHFFFAOYSA-N |