1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
TL;DR: 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile (CAS 98488-44-9) is a chemical compound with molecular formula C8H9N3O3 and molecular weight 195.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-hydroxypropyl)-2,4-dioxopyrimidine-5-carbonitrile
Also Known As: 1-(2-hydroxypropyl)-2,4-dioxopyrimidine-5-carbonitrile, AJ-030/12105932, 1-(2-hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile, 1-(2-hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinecarbonitrile, F2185-1159
| Molecular Formula | C8H9N3O3 |
|---|---|
| Molecular Weight | 195.06 g/mol |
| LogP | -1.21092 |
| Topological Polar Surface Area | 98.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.06439 |
| Heavy Atoms | 14 |
| Complexity | 477.83047 |
Chemical Identifiers
| CAS Number | 98488-44-9 |
|---|---|
| SMILES | CC(CN1C=C(C(=O)NC1=O)C#N)O |
Product Overview
1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile (CAS 98488-44-9), with molecular formula C8H9N3O3 and molecular weight 195.06 g/mol. IUPAC: 1-(2-hydroxypropyl)-2,4-dioxopyrimidine-5-carbonitrile.
Chemical Property Profile of 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
Property Insights of 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
The XLogP value of -1.21092 indicates that 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile. Following Lipinski's Rule of Five, 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile has 2 hydrogen bond donor(s) and 4 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-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile?
The CAS number of 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile is 98488-44-9.
What is the molecular formula of 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile?
The molecular formula of 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile is C8H9N3O3.
What is the molecular weight of 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile?
The molecular weight of 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile is 195.06 g/mol.
Where can I buy 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile?
You can request a quote for 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Hydroxypropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.