N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯
TL;DR: N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯 (CAS 68499-62-7) is a chemical compound with molecular formula C16H22BrNO10 and molecular weight 467.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯
[(2R,3R,4R,5R,6S)-3,4,6-triacetyloxy-5-[(2-bromoacetyl)amino]oxan-2-yl]methyl acetate
Also Known As: N-Bromoacetyl-beta-D-galactosamine tetra-O-acetate, Sid 775643, 1,3,4,6-Tetra-O-acetyl-2-deoxy-2-(bromoacetamido)-beta-D-galactose, beta-D-Galactopyranose, 2-((bromoacetyl)amino)-2-deoxy-, 1,3,4,6-tetraacetate, [(2R,3R,4R,5R,6S)-3,4,6-triacetyloxy-5-[(2-bromoacetyl)amino]oxan-2-yl]methyl acetate
| Molecular Formula | C16H22BrNO10 |
|---|---|
| Molecular Weight | 467.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 467.04272 |
| Heavy Atoms | 28 |
| Complexity | 625.0 |
Chemical Identifiers
| CAS Number | 68499-62-7 |
|---|---|
| SMILES | CC(=O)OC[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)OC(=O)C)NC(=O)CBr)OC(=O)C)OC(=O)C |
| InChIKey | HFBHVAHHJGXCMR-YMILTQATSA-N |
Product Overview
N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯 (CAS 68499-62-7), with molecular formula C16H22BrNO10 and molecular weight 467.04 g/mol. IUPAC: [(2R,3R,4R,5R,6S)-3,4,6-triacetyloxy-5-[(2-bromoacetyl)amino]oxan-2-yl]methyl acetate.
Chemical Property Profile of N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯
Property Insights of N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯. The TPSA of 144.0 Ų indicates high polarity, suggesting N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯 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 N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯?
The CAS number of N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯 is 68499-62-7.
What is the molecular formula of N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯?
The molecular formula of N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯 is C16H22BrNO10.
What is the molecular weight of N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯?
The molecular weight of N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯 is 467.04 g/mol.
Where can I buy N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯?
You can request a quote for N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯?
Yes, KEHONG BIO provides custom synthesis services for N-溴乙酰-β-D-氨基半乳糖四-O-乙酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.