1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid
TL;DR: 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid (CAS 131579-68-5) is a chemical compound with molecular formula C13H13N3O9S and molecular weight 387.03726 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[4-(5-nitrofuran-2-yl)-1,3-thiazol-2-yl]amino]oxane-2-carboxylic acid
Also Known As: 1-Anftdg, 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxy-beta-D-glucopyranuronic acid, 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid, (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[4-(5-nitrofuran-2-yl)-1,3-thiazol-2-yl]amino]oxane-2-carboxylic acid, N-[4-(5-Nitrofuran-2-yl)-1,3-thiazol-2-yl]hexopyranuronosylamine
Technical Specifications
| Molecular Formula | C13H13N3O9S |
| Molecular Weight | 387.03726 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 219.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.03726 Da |
| Heavy Atoms | 26 |
| Complexity | 549.0 |
| SMILES | C1=C(OC(=C1)[N+](=O)[O-])C2=CSC(=N2)N[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)C(=O)O)O)O)O |
| InChIKey | UNZPLCRPWDUWLK-QUARPLMYSA-N |
Chemical Property Profile of 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid
Property Insights of 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid. The TPSA of 219.0 Ų indicates high polarity, suggesting 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid has 5 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid?
The CAS number of 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid is 131579-68-5.
What is the molecular formula of 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid?
The molecular formula of 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid is C13H13N3O9S.
What is the molecular weight of 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid?
The molecular weight of 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid is 387.03726 g/mol.
Where can I buy 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid?
You can request a quote for 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid?
Yes, CoreyChem provides custom synthesis services for 1-(2-Amino-4-(5-nitro-2-furyl)-2-thiazolyl)-1-deoxyglucopyranuronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.