N-(4-methylbenzene-1-sulfonyl)-4-nitro-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)benzamide
Chemical Structure Depiction of
N-(4-methylbenzene-1-sulfonyl)-4-nitro-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)benzamide
N-(4-methylbenzene-1-sulfonyl)-4-nitro-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)benzamide
Compound characteristics
| Compound ID: | 6791-0014 |
| Compound Name: | N-(4-methylbenzene-1-sulfonyl)-4-nitro-N-(2-oxo-2H-naphtho[2,1-d][1,3]oxathiol-5-yl)benzamide |
| Molecular Weight: | 520.54 |
| Molecular Formula: | C25 H16 N2 O7 S2 |
| Smiles: | Cc1ccc(cc1)S(N(C(c1ccc(cc1)[N+]([O-])=O)=O)c1cc2c(c3ccccc13)OC(=O)S2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5399 |
| logD: | 5.5399 |
| logSw: | -5.7164 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 100.112 |
| InChI Key: | QQKQTGURWZSYRZ-UHFFFAOYSA-N |