N-{4-[rel-(3R,4S)-4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-1,1-dioxo-1lambda~6~-thiolane-3-sulfonyl]phenyl}acetamide
Chemical Structure Depiction of
N-{4-[rel-(3R,4S)-4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-1,1-dioxo-1lambda~6~-thiolane-3-sulfonyl]phenyl}acetamide
N-{4-[rel-(3R,4S)-4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-1,1-dioxo-1lambda~6~-thiolane-3-sulfonyl]phenyl}acetamide
Compound characteristics
| Compound ID: | D470-2361 |
| Compound Name: | N-{4-[rel-(3R,4S)-4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-1,1-dioxo-1lambda~6~-thiolane-3-sulfonyl]phenyl}acetamide |
| Molecular Weight: | 440.58 |
| Molecular Formula: | C20 H28 N2 O5 S2 |
| Smiles: | CC(Nc1ccc(cc1)S([C@H]1CS(C[C@@H]1NCCC1CCCCC=1)(=O)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.6783 |
| logD: | 0.6782 |
| logSw: | -1.9198 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.144 |
| InChI Key: | ONMKRLMRDYLQCH-WOJBJXKFSA-N |