5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸
TL;DR: 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸 (CAS 3031-95-6) is a chemical compound with molecular formula C13H19N4O12P and molecular weight 454.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸
2-[[5-amino-1-[3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]imidazole-4-carbonyl]amino]butanedioic acid
Also Known As: SAICAR, (2S)-2-[[5-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]imidazole-4-carbonyl]amino]butanedioic acid, 2-[(5-Amino-1-{3,4-dihydroxy-5-[(phosphonooxy)methyl]oxolan-2-yl}imidazol-4-yl)formamido]butanedioic acid, 2-[[5-amino-1-[3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]imidazole-4-carbonyl]amino]butanedioic acid
| Molecular Formula | C13H19N4O12P |
|---|---|
| Molecular Weight | 454.07 g/mol |
| LogP | -4.3 |
| Topological Polar Surface Area | 264.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 9 |
| Exact Mass | 454.0737 |
| Heavy Atoms | 30 |
| Complexity | 718.0 |
Chemical Identifiers
| CAS Number | 3031-95-6 |
|---|---|
| SMILES | C1=NC(=C(N1C2C(C(C(O2)COP(=O)(O)O)O)O)N)C(=O)NC(CC(=O)O)C(=O)O |
| InChIKey | NAQGHJTUZRHGAC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸 (CAS 3031-95-6), with molecular formula C13H19N4O12P and molecular weight 454.07 g/mol. IUPAC: 2-[[5-amino-1-[3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]imidazole-4-carbonyl]amino]butanedioic acid.
Chemical Property Profile of 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸
Property Insights of 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸
The XLogP value of -4.3 indicates that 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 264.0 Ų indicates high polarity, suggesting 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸 has 8 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸?
The CAS number of 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸 is 3031-95-6.
What is the molecular formula of 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸?
The molecular formula of 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸 is C13H19N4O12P.
What is the molecular weight of 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸?
The molecular weight of 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸 is 454.07 g/mol.
Where can I buy 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸?
You can request a quote for 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸?
Yes, KEHONG BIO provides custom synthesis services for 5-氨基咪唑-4-(N-琥珀基)-甲酰胺核苷酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.