5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶
TL;DR: 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶 (CAS 28100-77-8) is a chemical compound with molecular formula C11H15N5O6 and molecular weight 313.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶
2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-methyl-7H-purine-6,8-dione
Also Known As: 2-amino-1-methyl-9-pentofuranosyl-7,9-dihydro-1h-purine-6,8-dione, 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-methyl-7H-purine-6,8-dione
| Molecular Formula | C11H15N5O6 |
|---|---|
| Molecular Weight | 313.10 g/mol |
| LogP | -3.4 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.10223 |
| Heavy Atoms | 22 |
| Complexity | 604.0 |
Chemical Identifiers
| CAS Number | 28100-77-8 |
|---|---|
| SMILES | CN1C(=O)C2=C(N=C1N)N(C(=O)N2)C3C(C(C(O3)CO)O)O |
| InChIKey | WDIKEWFPOPVNCX-UHFFFAOYSA-N |
Product Overview
5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶 (CAS 28100-77-8), with molecular formula C11H15N5O6 and molecular weight 313.10 g/mol. IUPAC: 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-methyl-7H-purine-6,8-dione.
Chemical Property Profile of 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶
Property Insights of 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶
The XLogP value of -3.4 indicates that 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.0 Ų indicates high polarity, suggesting 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶 has 5 hydrogen bond donor(s) and 7 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 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶?
The CAS number of 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶 is 28100-77-8.
What is the molecular formula of 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶?
The molecular formula of 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶 is C11H15N5O6.
What is the molecular weight of 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶?
The molecular weight of 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶 is 313.10 g/mol.
Where can I buy 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶?
You can request a quote for 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶?
Yes, KEHONG BIO provides custom synthesis services for 5,6-双氢-5(α-胸腺嘧啶基)胸腺嘧啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.