TL;DR: 3Pehpc (CAS 152831-36-2) is a chemical compound with molecular formula C8H10NO6P and molecular weight 247.02457 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxy-2-phosphono-3-pyridin-3-ylpropanoic acid
Also Known As: 3Pehpc, 2-hydroxy-2-phosphono-3-(pyridin-3-yl)propanoic acid, NE 10790, 3-PEHPC, EX-A3623
| Molecular Formula | C8H10NO6P |
| Molecular Weight | 247.02457 g/mol |
| XLogP | -1.8 |
| Topological Polar Surface Area (TPSA) | 128.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 247.02457 Da |
| Heavy Atoms | 16 |
| Complexity | 316.0 |
| SMILES | C1=CC(=CN=C1)CC(C(=O)O)(O)P(=O)(O)O |
| InChIKey | FJVYPXVLXQXDHM-UHFFFAOYSA-N |
The XLogP value of -1.8 indicates that 3Pehpc is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3Pehpc. Following Lipinski's Rule of Five, 3Pehpc has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3Pehpc is 152831-36-2.
The molecular formula of 3Pehpc is C8H10NO6P.
The molecular weight of 3Pehpc is 247.02457 g/mol.
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