N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | G008-1937 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylbenzene-1-sulfonamide |
| Molecular Weight: | 400.45 |
| Molecular Formula: | C20 H20 N2 O5 S |
| Smiles: | Cc1ccc(cc1S(NCc1ccc2c(c1)OCO2)(=O)=O)c1c(C)c(C)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.1483 |
| logD: | 4.1476 |
| logSw: | -4.2282 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.457 |
| InChI Key: | PMARRQGOWVQCGX-UHFFFAOYSA-N |