N-(2-oxo-2H-1,3-benzoxathiol-5-yl)-N-[4-(propan-2-yl)benzene-1-sulfonyl]butanamide
Chemical Structure Depiction of
N-(2-oxo-2H-1,3-benzoxathiol-5-yl)-N-[4-(propan-2-yl)benzene-1-sulfonyl]butanamide
N-(2-oxo-2H-1,3-benzoxathiol-5-yl)-N-[4-(propan-2-yl)benzene-1-sulfonyl]butanamide
Compound characteristics
| Compound ID: | 7202-1122 |
| Compound Name: | N-(2-oxo-2H-1,3-benzoxathiol-5-yl)-N-[4-(propan-2-yl)benzene-1-sulfonyl]butanamide |
| Molecular Weight: | 419.52 |
| Molecular Formula: | C20 H21 N O5 S2 |
| Smiles: | CCCC(N(c1ccc2c(c1)SC(=O)O2)S(c1ccc(cc1)C(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.868 |
| logD: | 4.868 |
| logSw: | -4.6606 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.363 |
| InChI Key: | FQPFVQPWOVDROU-UHFFFAOYSA-N |