N-(4-methylbenzene-1-sulfonyl)-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)butanamide
Chemical Structure Depiction of
N-(4-methylbenzene-1-sulfonyl)-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)butanamide
N-(4-methylbenzene-1-sulfonyl)-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)butanamide
Compound characteristics
| Compound ID: | 6791-0020 |
| Compound Name: | N-(4-methylbenzene-1-sulfonyl)-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)butanamide |
| Molecular Weight: | 441.52 |
| Molecular Formula: | C22 H19 N O5 S2 |
| Smiles: | CCCC(N(c1cc2c(c3ccccc13)OC(=O)S2)S(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2539 |
| logD: | 5.2539 |
| logSw: | -5.3053 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 66.474 |
| InChI Key: | AFCUJGHEWCDKJQ-UHFFFAOYSA-N |