N-{4-[rel-(3R,4S)-4-{[(3-methylphenyl)methyl]amino}-1,1-dioxo-1lambda~6~-thiolane-3-sulfonyl]phenyl}acetamide
Chemical Structure Depiction of
N-{4-[rel-(3R,4S)-4-{[(3-methylphenyl)methyl]amino}-1,1-dioxo-1lambda~6~-thiolane-3-sulfonyl]phenyl}acetamide
N-{4-[rel-(3R,4S)-4-{[(3-methylphenyl)methyl]amino}-1,1-dioxo-1lambda~6~-thiolane-3-sulfonyl]phenyl}acetamide
Compound characteristics
| Compound ID: | D470-2372 |
| Compound Name: | N-{4-[rel-(3R,4S)-4-{[(3-methylphenyl)methyl]amino}-1,1-dioxo-1lambda~6~-thiolane-3-sulfonyl]phenyl}acetamide |
| Molecular Weight: | 436.55 |
| Molecular Formula: | C20 H24 N2 O5 S2 |
| Smiles: | CC(Nc1ccc(cc1)S([C@H]1CS(C[C@@H]1NCc1cccc(C)c1)(=O)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.8312 |
| logD: | 0.831 |
| logSw: | -2.0217 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.11 |
| InChI Key: | VEKVODPGBMFTJY-WOJBJXKFSA-N |