6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one
TL;DR: 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one (CAS 89889-83-8) is a chemical compound with molecular formula C18H20N4O5 and molecular weight 372.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methylpyrazolo[4,5-d]pyrimidin-7-one
Also Known As: 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one, 6-Benzyl-3-methyl-1-(beta-D-ribofuranosyl)-7H-pyrazolo[4,3-d]pyrimidin-7-one, 6-Benzyl-3-methyl-1-beta-D-ribofuranosyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one, 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo[4,3-d]pyrimidin-7-one, 6-benzyl-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methyl-1H,6H,7H-pyrazolo[4,3-d]pyrimidin-7-one
| Molecular Formula | C18H20N4O5 |
|---|---|
| Molecular Weight | 372.14 g/mol |
| LogP | -0.43878 |
| Topological Polar Surface Area | 122.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.14337 |
| Heavy Atoms | 27 |
| Complexity | 1015.75903 |
Chemical Identifiers
| CAS Number | 89889-83-8 |
|---|---|
| SMILES | CC1=NN(C2=C1N=CN(C2=O)CC3=CC=CC=C3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O |
Product Overview
6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one (CAS 89889-83-8), with molecular formula C18H20N4O5 and molecular weight 372.14 g/mol. IUPAC: 6-benzyl-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-methylpyrazolo[4,5-d]pyrimidin-7-one.
Chemical Property Profile of 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one
Property Insights of 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one
The XLogP value of -0.43878 indicates that 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 122.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one. Following Lipinski's Rule of Five, 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one has 3 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 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one?
The CAS number of 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one is 89889-83-8.
What is the molecular formula of 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one?
The molecular formula of 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one is C18H20N4O5.
What is the molecular weight of 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one?
The molecular weight of 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one is 372.14 g/mol.
Where can I buy 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one?
You can request a quote for 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Benzyl-1-(3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-3-methyl-1,6-dihydro-pyrazolo(4,3-d)pyrimidin-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.