6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)-
TL;DR: 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)- (CAS 104715-68-6) is a chemical compound with molecular formula C15H17N5S and molecular weight 299.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-butylanilino)-3,7-dihydropurine-6-thione
Also Known As: 2-(p-n-Butylphenyl)-6-thioguanine, 2-(4-Butylanilino)-9H-purine-6-thiol, 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)-, NCI60_030848, 1,9-Dihydro-2-((4-butylphenyl)amino)-6H-purine-6-thione
| Molecular Formula | C15H17N5S |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | 4.10169 |
| Topological Polar Surface Area | 69.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 299.12045 |
| Heavy Atoms | 21 |
| Complexity | 787.67926 |
Chemical Identifiers
| CAS Number | 104715-68-6 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)NC2=NC(=S)C3=C(N2)N=CN3 |
Product Overview
6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)- (CAS 104715-68-6), with molecular formula C15H17N5S and molecular weight 299.12 g/mol. IUPAC: 2-(4-butylanilino)-3,7-dihydropurine-6-thione.
Chemical Property Profile of 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)-
Property Insights of 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)-
The XLogP value of 4.10169 indicates that 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)-. Following Lipinski's Rule of Five, 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)- 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 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)-?
The CAS number of 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)- is 104715-68-6.
What is the molecular formula of 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)-?
The molecular formula of 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)- is C15H17N5S.
What is the molecular weight of 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)-?
The molecular weight of 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)- is 299.12 g/mol.
Where can I buy 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)-?
You can request a quote for 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for 6H-Purine-6-thione, 1,9-dihydro-2-((4-butylphenyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.