![7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione structure](/static/products/1069/106939-25-7.webp)
7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione
TL;DR: 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione (CAS 106939-25-7) is a chemical compound with molecular formula C15H20ClN5O2 and molecular weight 337.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione
Also Known As: BAS 00390238, 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione, 7-(3-Chloro-but-2-enyl)-3-methyl-8-piperidin-1-yl-3,7-dihydro-purine-2,6-dione, (Z)-7-(3-chlorobut-2-en-1-yl)-3-methyl-8-(piperidin-1-yl)-1H-purine-2,6(3H,7H)-dione, 7-((2Z)-3-chlorobut-2-enyl)-3-methyl-8-piperidyl-1,3,7-trihydropurine-2,6-dion e
| Molecular Formula | C15H20ClN5O2 |
|---|---|
| Molecular Weight | 337.13 g/mol |
| LogP | 1.5562 |
| Topological Polar Surface Area | 75.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.13055 |
| Heavy Atoms | 23 |
| Complexity | 866.34515 |
Chemical Identifiers
| CAS Number | 106939-25-7 |
|---|---|
| SMILES | C/C(=C/CN1C2=C(N=C1N3CCCCC3)N(C(=O)NC2=O)C)/Cl |
Product Overview
7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione (CAS 106939-25-7), with molecular formula C15H20ClN5O2 and molecular weight 337.13 g/mol. IUPAC: 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione.
Chemical Property Profile of 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione
Property Insights of 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione
The XLogP value of 1.5562 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione. The TPSA of 75.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione. Following Lipinski's Rule of Five, 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione has 1 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 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione?
The CAS number of 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione is 106939-25-7.
What is the molecular formula of 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione?
The molecular formula of 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione is C15H20ClN5O2.
What is the molecular weight of 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione?
The molecular weight of 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione is 337.13 g/mol.
Where can I buy 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione?
You can request a quote for 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-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-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-[(Z)-3-chlorobut-2-enyl]-3-methyl-8-piperidin-1-ylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.