rel-(3R,4S)-3-(4-chlorobenzene-1-sulfonyl)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
rel-(3R,4S)-3-(4-chlorobenzene-1-sulfonyl)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1lambda~6~-thiolane-1,1-dione
rel-(3R,4S)-3-(4-chlorobenzene-1-sulfonyl)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D470-2229 |
| Compound Name: | rel-(3R,4S)-3-(4-chlorobenzene-1-sulfonyl)-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 435.94 |
| Molecular Formula: | C17 H22 Cl N O6 S2 |
| Smiles: | C1CN(CCC12OCCO2)[C@H]1CS(C[C@@H]1S(c1ccc(cc1)[Cl])(=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9671 |
| logD: | 0.9671 |
| logSw: | -2.4875 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 75.364 |
| InChI Key: | KAHWVLRAKXAAQC-HOTGVXAUSA-N |