7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one
TL;DR: 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one (CAS 138787-11-8) is a chemical compound with molecular formula C17H19N5O5 and molecular weight 373.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-benzyl-5-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methylpyrazolo[4,5-d]triazin-4-one
Also Known As: 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one, 7-Benzyl-3-methyl-N5-.beta.-D-ribofuranosylpyrazolo[4,3-d]-1,2,3-triazin-4-one, 7-Benzyl-3-methyl-5-beta-D-ribofuranosyl-3,5-dihydro-4H-pyrazolo[4,3-d][1,2,3]triazin-4-one, 7-benzyl-5-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methylpyrazolo[4,3-d]triazin-4-one, 7-benzyl-5-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3-methyl-pyrazolo[4,3-d]triazin-4-one
| Molecular Formula | C17H19N5O5 |
|---|---|
| Molecular Weight | 373.14 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 373.1386 |
| Heavy Atoms | 27 |
| Complexity | 586.0 |
Chemical Identifiers
| CAS Number | 138787-11-8 |
|---|---|
| SMILES | CN1C(=O)C2=C(C(=NN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)CC4=CC=CC=C4)N=N1 |
| InChIKey | XLXXZPHDNZLJBW-BNGXUDDSSA-N |
Product Overview
7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one (CAS 138787-11-8), with molecular formula C17H19N5O5 and molecular weight 373.14 g/mol. IUPAC: 7-benzyl-5-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methylpyrazolo[4,5-d]triazin-4-one.
Chemical Property Profile of 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one
Property Insights of 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one. Following Lipinski's Rule of Five, 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one has 3 hydrogen bond donor(s) and 8 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 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one?
The CAS number of 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one is 138787-11-8.
What is the molecular formula of 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one?
The molecular formula of 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one is C17H19N5O5.
What is the molecular weight of 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one?
The molecular weight of 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one is 373.14 g/mol.
Where can I buy 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one?
You can request a quote for 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 7-Benzyl-3-methyl-N5-beta-D-ribofuranosylpyrazolo(4,3-d)-1,2,3-triazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.