N-[2-(4-methylbenzene-1-sulfonyl)-2-(thiophen-2-yl)ethyl]-4-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(4-methylbenzene-1-sulfonyl)-2-(thiophen-2-yl)ethyl]-4-nitrobenzene-1-sulfonamide
N-[2-(4-methylbenzene-1-sulfonyl)-2-(thiophen-2-yl)ethyl]-4-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | G857-1617 |
| Compound Name: | N-[2-(4-methylbenzene-1-sulfonyl)-2-(thiophen-2-yl)ethyl]-4-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 466.55 |
| Molecular Formula: | C19 H18 N2 O6 S3 |
| Smiles: | Cc1ccc(cc1)S(C(CNS(c1ccc(cc1)[N+]([O-])=O)(=O)=O)c1cccs1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9343 |
| logD: | 3.9333 |
| logSw: | -3.9184 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.897 |
| InChI Key: | QTXISMSXRUMHHD-IBGZPJMESA-N |