alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate
TL;DR: alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate (CAS 74729-54-7) is a chemical compound with molecular formula C15H22ClN3O9 and molecular weight 423.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,6-diacetyloxy-5-[[2-chloroethyl(nitroso)carbamoyl]amino]-2-methyloxan-3-yl] acetate
Also Known As: .alpha.-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate, [4,6-diacetyloxy-5-[[2-chloroethyl(nitroso)carbamoyl]amino]-2-methyloxan-3-yl] acetate, 1-(2-Chloroethyl)-3-(2,6-dideoxy-1,3,4-tri-O-acetyl-D-glucopyranos-2-yl)-1-nitrosourea, Urea, 1-(2-chloroethyl)-3-(2,6-dideoxy-1,3,4-tri-O-acetyl-D-glucopyranos-2-yl)-1-nitroso-
| Molecular Formula | C15H22ClN3O9 |
|---|---|
| Molecular Weight | 423.10 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 423.10446 |
| Heavy Atoms | 28 |
| Complexity | 618.0 |
Chemical Identifiers
| CAS Number | 74729-54-7 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC(=O)C)NC(=O)N(CCCl)N=O)OC(=O)C)OC(=O)C |
| InChIKey | SCJPIULIASRFNK-UHFFFAOYSA-N |
Product Overview
alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate (CAS 74729-54-7), with molecular formula C15H22ClN3O9 and molecular weight 423.10 g/mol. IUPAC: [4,6-diacetyloxy-5-[[2-chloroethyl(nitroso)carbamoyl]amino]-2-methyloxan-3-yl] acetate.
Chemical Property Profile of alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate
Property Insights of alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate. The TPSA of 150.0 Ų indicates high polarity, suggesting alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate has 1 hydrogen bond donor(s) and 10 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 alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate?
The CAS number of alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate is 74729-54-7.
What is the molecular formula of alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate?
The molecular formula of alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate is C15H22ClN3O9.
What is the molecular weight of alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate?
The molecular weight of alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate is 423.10 g/mol.
Where can I buy alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate?
You can request a quote for alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate?
Yes, KEHONG BIO provides custom synthesis services for alpha-D-Glucopyranose,6-dideoxy-, 1,3,4-triacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.