7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione
TL;DR: 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione (CAS 478253-00-8) is a chemical compound with molecular formula C15H16ClN5O3 and molecular weight 349.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione
Also Known As: 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione, 7-(3-Chlorobut-2-en-1-yl)-8-((furan-2-ylmethyl)amino)-3-methyl-1H-purine-2,6(3H,7H)-dione, 7-[(2Z)-3-chlorobut-2-en-1-yl]-8-{[(furan-2-yl)methyl]amino}-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
| Molecular Formula | C15H16ClN5O3 |
|---|---|
| Molecular Weight | 349.09 g/mol |
| LogP | 1.771 |
| Topological Polar Surface Area | 97.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.09418 |
| Heavy Atoms | 24 |
| Complexity | 1006.321 |
Chemical Identifiers
| CAS Number | 478253-00-8 |
|---|---|
| SMILES | CC(=CCN1C2=C(N=C1NCC3=CC=CO3)N(C(=O)NC2=O)C)Cl |
Product Overview
7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione (CAS 478253-00-8), with molecular formula C15H16ClN5O3 and molecular weight 349.09 g/mol. IUPAC: 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione.
Chemical Property Profile of 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione
Property Insights of 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione
The XLogP value of 1.771 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione. The TPSA of 97.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione. Following Lipinski's Rule of Five, 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione has 2 hydrogen bond donor(s) and 5 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 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione?
The CAS number of 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione is 478253-00-8.
What is the molecular formula of 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione?
The molecular formula of 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione is C15H16ClN5O3.
What is the molecular weight of 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione?
The molecular weight of 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione is 349.09 g/mol.
Where can I buy 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione?
You can request a quote for 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-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 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-(3-chlorobut-2-enyl)-8-(furan-2-ylmethylamino)-3-methylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.