3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose
TL;DR: 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose (CAS 100821-69-0) is a chemical compound with molecular formula C9H17N3O7 and molecular weight 279.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-1-nitroso-3-[(2R,3R,4R,5R)-4,5,6-trihydroxy-3-methoxy-1-oxohexan-2-yl]urea
Also Known As: Mmnacag, 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose, 1-methyl-1-nitroso-3-[(2R,3R,4R,5R)-4,5,6-trihydroxy-3-methoxy-1-oxohexan-2-yl]urea, 2-Deoxy-3-O-methyl-2-(((methylnitrosoamino)carbonyl)amino)-D-glucose, D-Glucose, 2-deoxy-3-O-methyl-2-(((methylnitrosoamino)carbonyl)amino)-
| Molecular Formula | C9H17N3O7 |
|---|---|
| Molecular Weight | 279.11 g/mol |
| LogP | -2.6 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 279.10666 |
| Heavy Atoms | 19 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 100821-69-0 |
|---|---|
| SMILES | CN(C(=O)N[C@@H](C=O)[C@H]([C@@H]([C@@H](CO)O)O)OC)N=O |
| InChIKey | QVXLRSXRLWPYDB-LXGUWJNJSA-N |
Product Overview
3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose (CAS 100821-69-0), with molecular formula C9H17N3O7 and molecular weight 279.11 g/mol. IUPAC: 1-methyl-1-nitroso-3-[(2R,3R,4R,5R)-4,5,6-trihydroxy-3-methoxy-1-oxohexan-2-yl]urea.
Chemical Property Profile of 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose
Property Insights of 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose
The XLogP value of -2.6 indicates that 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 149.0 Ų indicates high polarity, suggesting 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose?
The CAS number of 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose is 100821-69-0.
What is the molecular formula of 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose?
The molecular formula of 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose is C9H17N3O7.
What is the molecular weight of 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose?
The molecular weight of 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose is 279.11 g/mol.
Where can I buy 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose?
You can request a quote for 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose?
Yes, KEHONG BIO provides custom synthesis services for 3-O-Methyl-2-(((methylnitrosoamino)carbonyl)amino)glucopyranose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.