3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione
TL;DR: 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione (CAS 302801-95-2) is a chemical compound with molecular formula C9H11N5O2 and molecular weight 221.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione
Also Known As: 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione, 8-(allylamino)-3-methyl-3,7-dihydro-1H-purine-2,6-dione, 3-methyl-8-(prop-2-enylamino)-1,3,7-trihydropurine-2,6-dione, 8-(allylamino)-3-methyl-1H-purine-2,6(3H,7H)-dione, F0017-0651
| Molecular Formula | C9H11N5O2 |
|---|---|
| Molecular Weight | 221.09 g/mol |
| LogP | -0.4522 |
| Topological Polar Surface Area | 95.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.09128 |
| Heavy Atoms | 16 |
| Complexity | 647.9436 |
Chemical Identifiers
| CAS Number | 302801-95-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)NC(=N2)NCC=C |
Product Overview
3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione (CAS 302801-95-2), with molecular formula C9H11N5O2 and molecular weight 221.09 g/mol. IUPAC: 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione.
Chemical Property Profile of 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione
Property Insights of 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione
The XLogP value of -0.4522 indicates that 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 95.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione. Following Lipinski's Rule of Five, 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione has 3 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 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione?
The CAS number of 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione is 302801-95-2.
What is the molecular formula of 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione?
The molecular formula of 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione is C9H11N5O2.
What is the molecular weight of 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione?
The molecular weight of 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione is 221.09 g/mol.
Where can I buy 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione?
You can request a quote for 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-8-(prop-2-enylamino)-7H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.