9-pyrrolidin-1-yl-3H-purine-6-thione
TL;DR: 9-pyrrolidin-1-yl-3H-purine-6-thione (CAS 37154-84-0) is a chemical compound with molecular formula C9H11N5S and molecular weight 221.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-pyrrolidin-1-yl-3H-purine-6-thione
Also Known As: 9-pyrrolidin-1-yl-3H-purine-6-thione, 9-(Pyrrolidin-1-yl)-3,9-dihydro-6H-purine-6-thione
| Molecular Formula | C9H11N5S |
|---|---|
| Molecular Weight | 221.07 g/mol |
| LogP | 1.22069 |
| Topological Polar Surface Area | 49.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.07352 |
| Heavy Atoms | 15 |
| Complexity | 536.67145 |
Chemical Identifiers
| CAS Number | 37154-84-0 |
|---|---|
| SMILES | C1CCN(C1)N2C=NC3=C2NC=NC3=S |
Product Overview
9-pyrrolidin-1-yl-3H-purine-6-thione (CAS 37154-84-0), with molecular formula C9H11N5S and molecular weight 221.07 g/mol. IUPAC: 9-pyrrolidin-1-yl-3H-purine-6-thione.
Chemical Property Profile of 9-pyrrolidin-1-yl-3H-purine-6-thione
Property Insights of 9-pyrrolidin-1-yl-3H-purine-6-thione
The XLogP value of 1.22069 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-pyrrolidin-1-yl-3H-purine-6-thione. With a topological polar surface area (TPSA) of 49.74 Ų, 9-pyrrolidin-1-yl-3H-purine-6-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-pyrrolidin-1-yl-3H-purine-6-thione 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 9-pyrrolidin-1-yl-3H-purine-6-thione?
The CAS number of 9-pyrrolidin-1-yl-3H-purine-6-thione is 37154-84-0.
What is the molecular formula of 9-pyrrolidin-1-yl-3H-purine-6-thione?
The molecular formula of 9-pyrrolidin-1-yl-3H-purine-6-thione is C9H11N5S.
What is the molecular weight of 9-pyrrolidin-1-yl-3H-purine-6-thione?
The molecular weight of 9-pyrrolidin-1-yl-3H-purine-6-thione is 221.07 g/mol.
Where can I buy 9-pyrrolidin-1-yl-3H-purine-6-thione?
You can request a quote for 9-pyrrolidin-1-yl-3H-purine-6-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-pyrrolidin-1-yl-3H-purine-6-thione?
Yes, KEHONG BIO provides custom synthesis services for 9-pyrrolidin-1-yl-3H-purine-6-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.