N-(4-tert-butylbenzene-1-sulfonyl)-2-methyl-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)propanamide
Chemical Structure Depiction of
N-(4-tert-butylbenzene-1-sulfonyl)-2-methyl-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)propanamide
N-(4-tert-butylbenzene-1-sulfonyl)-2-methyl-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)propanamide
Compound characteristics
| Compound ID: | 6807-1298 |
| Compound Name: | N-(4-tert-butylbenzene-1-sulfonyl)-2-methyl-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)propanamide |
| Molecular Weight: | 433.54 |
| Molecular Formula: | C21 H23 N O5 S2 |
| Smiles: | CC(C)C(N(c1ccc2c(c1)SC(=O)O2)S(c1ccc(cc1)C(C)(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1108 |
| logD: | 5.1108 |
| logSw: | -5.0649 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.89 |
| InChI Key: | ZFFUNNQEWVHMPX-UHFFFAOYSA-N |