TL;DR: S-Trityl-D-penicillamine (CAS 150025-01-7) is a chemical compound with molecular formula C24H25NO2S and molecular weight 391.1606 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-amino-3-methyl-3-tritylsulfanylbutanoic acid
Also Known As: S-Trityl-D-penicillamine, H-D-PEN(TRT)-OH, s-trityl-penicillamine, S-Trityl-L-penicillanine, H-,-Dimethyl-D-Cys(Trt)-OH
| Molecular Formula | C24H25NO2S |
| Molecular Weight | 391.1606 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 93.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.1606 Da |
| Heavy Atoms | 28 |
| Complexity | 452.0 |
| SMILES | CC(C)([C@H](C(=O)O)N)SC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | XSOLHQWRHYIXOC-NRFANRHFSA-N |
The XLogP value of 3.2 indicates that S-Trityl-D-penicillamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for S-Trityl-D-penicillamine. Following Lipinski's Rule of Five, S-Trityl-D-penicillamine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of S-Trityl-D-penicillamine is 150025-01-7.
The molecular formula of S-Trityl-D-penicillamine is C24H25NO2S.
The molecular weight of S-Trityl-D-penicillamine is 391.1606 g/mol.
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