3P-702
TL;DR: 3P-702 (CAS 41278-82-4) is a chemical compound with molecular formula C10H4N6O3 and molecular weight 256.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-amino-2,4-dioxo-1H-pyrano[2,3-d]pyrimidine-5,5,6-tricarbonitrile
Also Known As: 3P-702, 7-amino-2,4-dioxo-1,2,3,4-tetrahydro-5H-pyrano[2,3-d]pyrimidine-5,5,6-tricarbonitrile, 7-amino-2,4-dioxo-1H-pyrano[2,3-d]pyrimidine-5,5,6-tricarbonitrile, 7-amino-2,4-dioxo-1H,2H,3H,4H,5H-pyrano[2,3-d]pyrimidine-5,5,6-tricarbonitrile, 8-amino-2,4-dioxo-7-oxa-3,5-diazabicyclo[4.4.0]deca-8,11-diene-9,10,10-tricarbonitrile
| Molecular Formula | C10H4N6O3 |
|---|---|
| Molecular Weight | 256.03 g/mol |
| LogP | -1.56556 |
| Topological Polar Surface Area | 172.34 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 256.0345 |
| Heavy Atoms | 19 |
| Complexity | 824.22205 |
Chemical Identifiers
| CAS Number | 41278-82-4 |
|---|---|
| SMILES | C(#N)C1=C(OC2=C(C1(C#N)C#N)C(=O)NC(=O)N2)N |
Product Overview
3P-702 (CAS 41278-82-4), with molecular formula C10H4N6O3 and molecular weight 256.03 g/mol. IUPAC: 7-amino-2,4-dioxo-1H-pyrano[2,3-d]pyrimidine-5,5,6-tricarbonitrile.
Chemical Property Profile of 3P-702
Property Insights of 3P-702
The XLogP value of -1.56556 indicates that 3P-702 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 172.34 Ų indicates high polarity, suggesting 3P-702 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3P-702 has 3 hydrogen bond donor(s) and 7 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 3P-702?
The CAS number of 3P-702 is 41278-82-4.
What is the molecular formula of 3P-702?
The molecular formula of 3P-702 is C10H4N6O3.
What is the molecular weight of 3P-702?
The molecular weight of 3P-702 is 256.03 g/mol.
Where can I buy 3P-702?
You can request a quote for 3P-702 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3P-702?
Yes, KEHONG BIO provides custom synthesis services for 3P-702 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.