4,6(1H,5H)-Pyrimidinedione, 2-amino-
TL;DR: 4,6(1H,5H)-Pyrimidinedione, 2-amino- (CAS 4425-67-6) is a chemical compound with molecular formula C4H5N3O2 and molecular weight 127.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1H-pyrimidine-4,6-dione
Also Known As: Malonylguanidine, Guanidine, malonyl-, 2-Iminobarbituric acid, 2-amino-1H-pyrimidine-4,6-dione, 2-Amino-4,6-dihydroxypyrimidine
| Molecular Formula | C4H5N3O2 |
|---|---|
| Molecular Weight | 127.04 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 84.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 127.03818 |
| Heavy Atoms | 9 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 4425-67-6 |
|---|---|
| SMILES | C1C(=O)NC(=NC1=O)N |
| InChIKey | BTYNVOQLMBUUMS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,6(1H,5H)-Pyrimidinedione, 2-amino- (CAS 4425-67-6), with molecular formula C4H5N3O2 and molecular weight 127.04 g/mol. IUPAC: 2-amino-1H-pyrimidine-4,6-dione.
Chemical Property Profile of 4,6(1H,5H)-Pyrimidinedione, 2-amino-
Property Insights of 4,6(1H,5H)-Pyrimidinedione, 2-amino-
The XLogP value of -1.5 indicates that 4,6(1H,5H)-Pyrimidinedione, 2-amino- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6(1H,5H)-Pyrimidinedione, 2-amino-. Following Lipinski's Rule of Five, 4,6(1H,5H)-Pyrimidinedione, 2-amino- has 2 hydrogen bond donor(s) and 2 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 4,6(1H,5H)-Pyrimidinedione, 2-amino-?
The CAS number of 4,6(1H,5H)-Pyrimidinedione, 2-amino- is 4425-67-6.
What is the molecular formula of 4,6(1H,5H)-Pyrimidinedione, 2-amino-?
The molecular formula of 4,6(1H,5H)-Pyrimidinedione, 2-amino- is C4H5N3O2.
What is the molecular weight of 4,6(1H,5H)-Pyrimidinedione, 2-amino-?
The molecular weight of 4,6(1H,5H)-Pyrimidinedione, 2-amino- is 127.04 g/mol.
Where can I buy 4,6(1H,5H)-Pyrimidinedione, 2-amino-?
You can request a quote for 4,6(1H,5H)-Pyrimidinedione, 2-amino- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6(1H,5H)-Pyrimidinedione, 2-amino-?
Yes, KEHONG BIO provides custom synthesis services for 4,6(1H,5H)-Pyrimidinedione, 2-amino- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.