ChemDiv1_023588
TL;DR: ChemDiv1_023588 (CAS 1094684-62-4) is a chemical compound with molecular formula C22H27NO11 and molecular weight 481.15842 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-[3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxybenzoate
Also Known As: methyl 2-{[4,5-bis(acetyloxy)-6-[(acetyloxy)methyl]-3-acetamidooxan-2-yl]oxy}benzoate, F1507-0121, methyl 2-[3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxybenzoate, 5-acetamido-2-(acetoxymethyl)-6-(2-(methoxycarbonyl)phenoxy)tetrahydro-2H-pyran-3,4-diyl diacetate, methyl 2-{[3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxyhexopyranosyl]oxy}benzoate
Technical Specifications
| Molecular Formula | C22H27NO11 |
| Molecular Weight | 481.15842 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 153.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 12 |
| Exact Mass | 481.15842 Da |
| Heavy Atoms | 34 |
| Complexity | 770.0 |
| SMILES | CC(=O)NC1C(C(C(OC1OC2=CC=CC=C2C(=O)OC)COC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | UFGDRADYRWUNPD-UHFFFAOYSA-N |
Chemical Property Profile of ChemDiv1_023588
Property Insights of ChemDiv1_023588
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_023588. The TPSA of 153.0 Ų indicates high polarity, suggesting ChemDiv1_023588 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ChemDiv1_023588 has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of ChemDiv1_023588?
The CAS number of ChemDiv1_023588 is 1094684-62-4.
What is the molecular formula of ChemDiv1_023588?
The molecular formula of ChemDiv1_023588 is C22H27NO11.
What is the molecular weight of ChemDiv1_023588?
The molecular weight of ChemDiv1_023588 is 481.15842 g/mol.
Where can I buy ChemDiv1_023588?
You can request a quote for ChemDiv1_023588 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ChemDiv1_023588?
Yes, CoreyChem provides custom synthesis services for ChemDiv1_023588 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.