TL;DR: PP36 (CAS 149970-61-6) is a chemical compound with molecular formula C31H45N5O10 and molecular weight 647.31665 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(decanoylamino)-3-hydroxy-3-phenylpropyl] N-[2-[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methylamino]-2-oxoethyl]carbamate
Also Known As: PP36, PP 36, 5'-((N-(2-Decanoylamino-3-hydroxy-3-phenylpropyloxycarbonyl)glycyl)amino)-5'-deoxyuridine, [2-(decanoylamino)-3-hydroxy-3-phenylpropyl] N-[2-[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methylamino]-2-oxoethyl]carbamate, Uridine, 5'-deoxy-5'-(((((3-hydroxy-2-((1-oxodecyl)amino)-3-phenylpropoxy)carbonyl)amino)acetyl)amino)-
| Molecular Formula | C31H45N5O10 |
| Molecular Weight | 647.31665 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 216.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 19 |
| Exact Mass | 647.31665 Da |
| Heavy Atoms | 46 |
| Complexity | 1050.0 |
| SMILES | CCCCCCCCCC(=O)NC(COC(=O)NCC(=O)NC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=CC(=O)NC2=O)O)O)C(C3=CC=CC=C3)O |
| InChIKey | BGHIQDBPGOFVES-KPVDWXPUSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for PP36. The TPSA of 216.0 Ų indicates high polarity, suggesting PP36 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, PP36 has 7 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of PP36 is 149970-61-6.
The molecular formula of PP36 is C31H45N5O10.
The molecular weight of PP36 is 647.31665 g/mol.
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