![5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione structure](/static/products/5547/55470-38-7.webp)
5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione
TL;DR: 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione (CAS 55470-38-7) is a chemical compound with molecular formula C13H15N7O4S and molecular weight 365.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione
Also Known As: 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione, .delta.2-1,4-Triazoline-5-thione, 3-(4-amino-7-.beta.-D-ribofuranosyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)-, 7-Pentofuranosyl-5-(5-sulfanylidene-2,5-dihydro-1H-1,2,4-triazol-3-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
| Molecular Formula | C13H15N7O4S |
|---|---|
| Molecular Weight | 365.09 g/mol |
| LogP | -0.92731 |
| Topological Polar Surface Area | 171.12 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 365.09064 |
| Heavy Atoms | 25 |
| Complexity | 982.3218 |
Chemical Identifiers
| CAS Number | 55470-38-7 |
|---|---|
| SMILES | C1=C(C2=C(N=CN=C2N1C3C(C(C(O3)CO)O)O)N)C4=NC(=S)NN4 |
Product Overview
5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione (CAS 55470-38-7), with molecular formula C13H15N7O4S and molecular weight 365.09 g/mol. IUPAC: 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione.
Chemical Property Profile of 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione
Property Insights of 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione
The XLogP value of -0.92731 indicates that 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 171.12 Ų indicates high polarity, suggesting 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione?
The CAS number of 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione is 55470-38-7.
What is the molecular formula of 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione?
The molecular formula of 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione is C13H15N7O4S.
What is the molecular weight of 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione?
The molecular weight of 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione is 365.09 g/mol.
Where can I buy 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione?
You can request a quote for 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 5-[4-amino-7-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidin-5-yl]-1,2-dihydro-1,2,4-triazole-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.