![2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol structure](/static/products/411/41165-57-5.png)
2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol
TL;DR: 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol (CAS 41165-57-5) is a chemical compound with molecular formula C22H32N4O3 and molecular weight 400.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-2-(3-piperidin-1-ylpropylamino)-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-6-one
Also Known As: 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol, 5-(4-isopropoxybenzyl)-2-((3-(piperidin-1-yl)propyl)amino)pyrimidine-4,6-diol, 4-hydroxy-2-(3-piperidin-1-ylpropylamino)-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-6-one, 6-hydroxy-2-[3-(1-piperidyl)propylamino]-5-[(4-propan-2-yloxyphenyl)methyl]-3H-pyrimidin-4-one
| Molecular Formula | C22H32N4O3 |
|---|---|
| Molecular Weight | 400.25 g/mol |
| LogP | 3.1414 |
| Topological Polar Surface Area | 90.48 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 400.24744 |
| Heavy Atoms | 29 |
| Complexity | 826.9413 |
Chemical Identifiers
| CAS Number | 41165-57-5 |
|---|---|
| SMILES | CC(C)OC1=CC=C(C=C1)CC2=C(N=C(NC2=O)NCCCN3CCCCC3)O |
Product Overview
2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol (CAS 41165-57-5), with molecular formula C22H32N4O3 and molecular weight 400.25 g/mol. IUPAC: 4-hydroxy-2-(3-piperidin-1-ylpropylamino)-5-[(4-propan-2-yloxyphenyl)methyl]-1H-pyrimidin-6-one.
Chemical Property Profile of 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol
Property Insights of 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol
The XLogP value of 3.1414 indicates that 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol. Following Lipinski's Rule of Five, 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol has 3 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-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol?
The CAS number of 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol is 41165-57-5.
What is the molecular formula of 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol?
The molecular formula of 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol is C22H32N4O3.
What is the molecular weight of 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol?
The molecular weight of 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol is 400.25 g/mol.
Where can I buy 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol?
You can request a quote for 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol?
Yes, KEHONG BIO provides custom synthesis services for 2-{[3-(piperidin-1-yl)propyl]amino}-5-[4-(propan-2-yloxy)benzyl]pyrimidine-4,6-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.