N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[5-(2,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[5-(2,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}-4-methylbenzene-1-sulfonamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[5-(2,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V003-0973 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N-{[5-(2,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 522.58 |
| Molecular Formula: | C27 H26 N2 O7 S |
| Smiles: | Cc1ccc(cc1)S(N(Cc1ccc2c(c1)OCO2)Cc1cc(c2ccc(cc2OC)OC)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3863 |
| logD: | 5.3863 |
| logSw: | -5.5626 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.662 |
| InChI Key: | KQYUFTOJGAVRBA-UHFFFAOYSA-N |