N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol
TL;DR: N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol (CAS 117894-13-0) is a chemical compound with molecular formula C7H15NO4 and molecular weight 177.10011 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,3S,4R)-2-[(1R)-1,2-dihydroxyethyl]-1-methylpyrrolidine-3,4-diol
Also Known As: MeDIM, MeLAB, N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol, 2-(1,2-Dihydroxyethyl)-1-methylpyrrolidine-3,4-diol, 3,4-Pyrrolidinediol, 2-((1S)-1,2-dihydroxyethyl)-, (2R,3S,4R)-
Technical Specifications
| Molecular Formula | C7H15NO4 |
| Molecular Weight | 177.10011 g/mol |
| XLogP | -1.9 |
| Topological Polar Surface Area (TPSA) | 84.2 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.10011 Da |
| Heavy Atoms | 12 |
| Complexity | 154.0 |
| SMILES | CN1C[C@H]([C@H]([C@H]1[C@H](CO)O)O)O |
| InChIKey | RVHKEUIYGMIGOM-XZBKPIIZSA-N |
Chemical Property Profile of N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol
Property Insights of N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol
The XLogP value of -1.9 indicates that N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol. Following Lipinski's Rule of Five, N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol?
The CAS number of N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol is 117894-13-0.
What is the molecular formula of N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol?
The molecular formula of N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol is C7H15NO4.
What is the molecular weight of N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol?
The molecular weight of N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol is 177.10011 g/mol.
Where can I buy N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol?
You can request a quote for N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol?
Yes, CoreyChem provides custom synthesis services for N-Methyl-1,4-dideoxy-1,4-imino-D-mannitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.