Desmethyl rabeprazole
TL;DR: Desmethyl rabeprazole (CAS 117976-94-0) is a chemical compound with molecular formula C17H19N3O3S and molecular weight 345.11472 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[[2-(1H-benzimidazol-2-ylsulfinylmethyl)-3-methyl-4-pyridinyl]oxy]propan-1-ol
Also Known As: Desmethyl rabeprazole, Rabeprazole Impurity 27, Rabeprazole Impurity 31, 1-Propanol, 3-[[2-[(1H-benzimidazol-2-ylsulfinyl)methyl]-3-methyl-4-pyridinyl]oxy]-, Racemic-O-Desmethyl Rabeprazole Impurity
Technical Specifications
| Molecular Formula | C17H19N3O3S |
| Molecular Weight | 345.11472 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 345.11472 Da |
| Heavy Atoms | 24 |
| Complexity | 426.0 |
| SMILES | CC1=C(C=CN=C1CS(=O)C2=NC3=CC=CC=C3N2)OCCCO |
| InChIKey | OBQCUJTXRBUDMO-UHFFFAOYSA-N |
Chemical Property Profile of Desmethyl rabeprazole
Property Insights of Desmethyl rabeprazole
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Desmethyl rabeprazole. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Desmethyl rabeprazole. Following Lipinski's Rule of Five, Desmethyl rabeprazole has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Desmethyl rabeprazole?
The CAS number of Desmethyl rabeprazole is 117976-94-0.
What is the molecular formula of Desmethyl rabeprazole?
The molecular formula of Desmethyl rabeprazole is C17H19N3O3S.
What is the molecular weight of Desmethyl rabeprazole?
The molecular weight of Desmethyl rabeprazole is 345.11472 g/mol.
Where can I buy Desmethyl rabeprazole?
You can request a quote for Desmethyl rabeprazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Desmethyl rabeprazole?
Yes, CoreyChem provides custom synthesis services for Desmethyl rabeprazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.