TL;DR: J1.624.346I (CAS 144862-20-4) is a chemical compound with molecular formula C12H20N2O6S and molecular weight 320.10422 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
prop-2-enyl (2S,4R)-2-(dimethylcarbamoyl)-4-methylsulfonyloxypyrrolidine-1-carboxylate
Also Known As: J1.624.346I, (2S,4R)-2-(Dimethylcarbamoyl)-4-(methylsulfonyloxy)-1-pyrrolidinecarboxylic acid allyl ester, 1-Pyrrolidinecarboxylic acid, 2-[(dimethylamino)carbonyl]-4-[(methylsulfonyl)oxy]-, 2-propen-1-yl ester, (2S,4R)-, (2S,4R)-1N-(allyloxycarbonyl)-4-methylsulfonyloxy-2-(N,N-dimethylcarbamoyl)pyrrolidine, Allyl (2S,4R)-2-(dimethylcarbamoyl)-4-((methylsulfonyl)oxy)pyrrolidine-1-carboxylate
| Molecular Formula | C12H20N2O6S |
| Molecular Weight | 320.10422 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 320.10422 Da |
| Heavy Atoms | 21 |
| Complexity | 510.0 |
| SMILES | CN(C)C(=O)[C@@H]1C[C@H](CN1C(=O)OCC=C)OS(=O)(=O)C |
| InChIKey | KDTAMBBMGYJTEJ-ZJUUUORDSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for J1.624.346I. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for J1.624.346I. Following Lipinski's Rule of Five, J1.624.346I has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of J1.624.346I is 144862-20-4.
The molecular formula of J1.624.346I is C12H20N2O6S.
The molecular weight of J1.624.346I is 320.10422 g/mol.
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