2-Pentofuranosyl-2H-indazole-3-carbothioamide
TL;DR: 2-Pentofuranosyl-2H-indazole-3-carbothioamide (CAS 31899-59-9) is a chemical compound with molecular formula C13H15N3O4S and molecular weight 309.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]indazole-3-carbothioamide
Also Known As: 2-Pentofuranosyl-2H-indazole-3-carbothioamide, 2H-indazole-3-carboxamide,2-b-d-ribofuranosylthio-(8ci), 2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]indazole-3-carbothioamide
| Molecular Formula | C13H15N3O4S |
|---|---|
| Molecular Weight | 309.08 g/mol |
| LogP | -0.718 |
| Topological Polar Surface Area | 113.76 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.07834 |
| Heavy Atoms | 21 |
| Complexity | 689.10626 |
Chemical Identifiers
| CAS Number | 31899-59-9 |
|---|---|
| SMILES | C1=CC2=C(N(N=C2C=C1)C3C(C(C(O3)CO)O)O)C(=S)N |
Product Overview
2-Pentofuranosyl-2H-indazole-3-carbothioamide (CAS 31899-59-9), with molecular formula C13H15N3O4S and molecular weight 309.08 g/mol. IUPAC: 2-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]indazole-3-carbothioamide.
Chemical Property Profile of 2-Pentofuranosyl-2H-indazole-3-carbothioamide
Property Insights of 2-Pentofuranosyl-2H-indazole-3-carbothioamide
The XLogP value of -0.718 indicates that 2-Pentofuranosyl-2H-indazole-3-carbothioamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Pentofuranosyl-2H-indazole-3-carbothioamide. Following Lipinski's Rule of Five, 2-Pentofuranosyl-2H-indazole-3-carbothioamide has 4 hydrogen bond donor(s) and 6 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 2-Pentofuranosyl-2H-indazole-3-carbothioamide?
The CAS number of 2-Pentofuranosyl-2H-indazole-3-carbothioamide is 31899-59-9.
What is the molecular formula of 2-Pentofuranosyl-2H-indazole-3-carbothioamide?
The molecular formula of 2-Pentofuranosyl-2H-indazole-3-carbothioamide is C13H15N3O4S.
What is the molecular weight of 2-Pentofuranosyl-2H-indazole-3-carbothioamide?
The molecular weight of 2-Pentofuranosyl-2H-indazole-3-carbothioamide is 309.08 g/mol.
Where can I buy 2-Pentofuranosyl-2H-indazole-3-carbothioamide?
You can request a quote for 2-Pentofuranosyl-2H-indazole-3-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pentofuranosyl-2H-indazole-3-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Pentofuranosyl-2H-indazole-3-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.