InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8
TL;DR: InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8 (CAS 31469-63-3) is a chemical compound with molecular formula C5H7N5O2 and molecular weight 169.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-diamino-3-methyl-5-nitrosopyrimidin-4-one
Also Known As: J1.093.748E, 2,6-diamino-3-methyl-5-nitrosopyrimidin-4(3H)-one, 2,6-diamino-3-methyl-5-nitroso-pyrimidin-4-one, 2,6-diamino-3-methyl-5-nitrosopyrimidin-4-one, 1-Methyl-2,4-diamino-5-nitrosopyrimidine-6(1H)-one
| Molecular Formula | C5H7N5O2 |
|---|---|
| Molecular Weight | 169.06 g/mol |
| LogP | -0.6574 |
| Topological Polar Surface Area | 116.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 169.05997 |
| Heavy Atoms | 12 |
| Complexity | 382.16034 |
Chemical Identifiers
| CAS Number | 31469-63-3 |
|---|---|
| SMILES | CN1C(=O)C(=C(N=C1N)N)N=O |
Product Overview
InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8 (CAS 31469-63-3), with molecular formula C5H7N5O2 and molecular weight 169.06 g/mol. IUPAC: 2,6-diamino-3-methyl-5-nitrosopyrimidin-4-one.
Chemical Property Profile of InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8
Property Insights of InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8
The XLogP value of -0.6574 indicates that InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 116.36 Ų falls within the moderate polarity range, balancing permeability and solubility for InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8. Following Lipinski's Rule of Five, InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8 has 2 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 InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8?
The CAS number of InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8 is 31469-63-3.
What is the molecular formula of InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8?
The molecular formula of InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8 is C5H7N5O2.
What is the molecular weight of InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8?
The molecular weight of InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8 is 169.06 g/mol.
Where can I buy InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8?
You can request a quote for InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8?
Yes, KEHONG BIO provides custom synthesis services for InChI=1/C5H7N5O2/c1-10-4(11)2(9-12)3(6)8-5(10)7/h6H2,1H3,(H2,7,8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.