4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone
TL;DR: 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone (CAS 56642-77-4) is a chemical compound with molecular formula C8H13N3O3 and molecular weight 199.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-1-(1,4-dihydroxybutan-2-yl)pyrimidin-2-one
Also Known As: n1-(1,4-dihydroxy-2-butyl)cytosine, 4-amino-1-(1,4-dihydroxybutan-2-yl)pyrimidin-2-one, 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone, 2(1H)-Pyrimidinone, 4-amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-, 2-(2-Hydroxy-4-iminopyrimidin-1(4H)-yl)butane-1,4-diol
| Molecular Formula | C8H13N3O3 |
|---|---|
| Molecular Weight | 199.10 g/mol |
| LogP | -2.1 |
| Topological Polar Surface Area | 99.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 199.09569 |
| Heavy Atoms | 14 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 56642-77-4 |
|---|---|
| SMILES | C1=CN(C(=O)N=C1N)C(CCO)CO |
| InChIKey | DXGBQPZURBRQHS-UHFFFAOYSA-N |
Product Overview
4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone (CAS 56642-77-4), with molecular formula C8H13N3O3 and molecular weight 199.10 g/mol. IUPAC: 4-amino-1-(1,4-dihydroxybutan-2-yl)pyrimidin-2-one.
Chemical Property Profile of 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone
Property Insights of 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone
The XLogP value of -2.1 indicates that 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone. Following Lipinski's Rule of Five, 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone has 3 hydrogen bond donor(s) and 3 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 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone?
The CAS number of 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone is 56642-77-4.
What is the molecular formula of 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone?
The molecular formula of 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone is C8H13N3O3.
What is the molecular weight of 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone?
The molecular weight of 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone is 199.10 g/mol.
Where can I buy 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone?
You can request a quote for 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-1-(3-hydroxy-1-(hydroxymethyl)propyl)-2(1H)-pyrimidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.