1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione
TL;DR: 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione (CAS 139870-62-5) is a chemical compound with molecular formula C11H18N2O5 and molecular weight 258.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3S,4R)-3,5-dihydroxy-4-methoxypentyl]-5-methylpyrimidine-2,4-dione
Also Known As: 1-(4-O-methyl-2-deoxy-D-ribityl)thymine, 1-[(3S,4R)-3,5-dihydroxy-4-methoxypentyl]-5-methylpyrimidine-2,4-dione, 1-((3'S,4'R)-3',5'-Dihydroxy-4'-methoxypentyl)-5-methyl-(1H,3H)-primidin-2,4-dione, 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione
| Molecular Formula | C11H18N2O5 |
|---|---|
| Molecular Weight | 258.12 g/mol |
| LogP | -1.39668 |
| Topological Polar Surface Area | 104.55 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 258.12158 |
| Heavy Atoms | 18 |
| Complexity | 488.94232 |
Chemical Identifiers
| CAS Number | 139870-62-5 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)CC[C@@H]([C@@H](CO)OC)O |
Product Overview
1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione (CAS 139870-62-5), with molecular formula C11H18N2O5 and molecular weight 258.12 g/mol. IUPAC: 1-[(3S,4R)-3,5-dihydroxy-4-methoxypentyl]-5-methylpyrimidine-2,4-dione.
Chemical Property Profile of 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione
Property Insights of 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione
The XLogP value of -1.39668 indicates that 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione. Following Lipinski's Rule of Five, 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione has 3 hydrogen bond donor(s) and 5 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 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione?
The CAS number of 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione is 139870-62-5.
What is the molecular formula of 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione?
The molecular formula of 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione is C11H18N2O5.
What is the molecular weight of 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione?
The molecular weight of 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione is 258.12 g/mol.
Where can I buy 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione?
You can request a quote for 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-[(3S,4R)-3,5-dihydroxy-4-methoxy-pentyl]-5-methyl-pyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.