N-(4-{rel-(3R,4S)-1,1-dioxo-4-[4-(pyrimidin-2-yl)piperazin-1-yl]-1lambda~6~-thiolane-3-sulfonyl}phenyl)acetamide
Chemical Structure Depiction of
N-(4-{rel-(3R,4S)-1,1-dioxo-4-[4-(pyrimidin-2-yl)piperazin-1-yl]-1lambda~6~-thiolane-3-sulfonyl}phenyl)acetamide
N-(4-{rel-(3R,4S)-1,1-dioxo-4-[4-(pyrimidin-2-yl)piperazin-1-yl]-1lambda~6~-thiolane-3-sulfonyl}phenyl)acetamide
Compound characteristics
| Compound ID: | D470-2424 |
| Compound Name: | N-(4-{rel-(3R,4S)-1,1-dioxo-4-[4-(pyrimidin-2-yl)piperazin-1-yl]-1lambda~6~-thiolane-3-sulfonyl}phenyl)acetamide |
| Molecular Weight: | 479.58 |
| Molecular Formula: | C20 H25 N5 O5 S2 |
| Smiles: | CC(Nc1ccc(cc1)S([C@H]1CS(C[C@@H]1N1CCN(CC1)c1ncccn1)(=O)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.0802 |
| logD: | 0.0801 |
| logSw: | -2.3148 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 105.812 |
| InChI Key: | RDTGETYTDVAZOM-RTBURBONSA-N |