9H-Purine-2,6-diamine, 9-(4-methylphenyl)-
TL;DR: 9H-Purine-2,6-diamine, 9-(4-methylphenyl)- (CAS 61971-98-0) is a chemical compound with molecular formula C12H12N6 and molecular weight 240.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(4-methylphenyl)purine-2,6-diamine
Also Known As: 9-(p-Tolyl)-9H-purine-2,6-diamine, 9-(4-methylphenyl)purine-2,6-diamine, 9-(4-methylphenyl)-9H-purine-2,6-diamine, 9-p-Tolyl-9H-purin-2,6-diyldiamin, 9H-Purine-2,6-diamine, 9-(4-methylphenyl)-
| Molecular Formula | C12H12N6 |
|---|---|
| Molecular Weight | 240.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 95.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.11235 |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 61971-98-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C=NC3=C(N=C(N=C32)N)N |
| InChIKey | OOILCYGVLKDEDD-UHFFFAOYSA-N |
Product Overview
9H-Purine-2,6-diamine, 9-(4-methylphenyl)- (CAS 61971-98-0), with molecular formula C12H12N6 and molecular weight 240.11 g/mol. IUPAC: 9-(4-methylphenyl)purine-2,6-diamine.
Chemical Property Profile of 9H-Purine-2,6-diamine, 9-(4-methylphenyl)-
Property Insights of 9H-Purine-2,6-diamine, 9-(4-methylphenyl)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9H-Purine-2,6-diamine, 9-(4-methylphenyl)-. The TPSA of 95.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 9H-Purine-2,6-diamine, 9-(4-methylphenyl)-. Following Lipinski's Rule of Five, 9H-Purine-2,6-diamine, 9-(4-methylphenyl)- 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 9H-Purine-2,6-diamine, 9-(4-methylphenyl)-?
The CAS number of 9H-Purine-2,6-diamine, 9-(4-methylphenyl)- is 61971-98-0.
What is the molecular formula of 9H-Purine-2,6-diamine, 9-(4-methylphenyl)-?
The molecular formula of 9H-Purine-2,6-diamine, 9-(4-methylphenyl)- is C12H12N6.
What is the molecular weight of 9H-Purine-2,6-diamine, 9-(4-methylphenyl)-?
The molecular weight of 9H-Purine-2,6-diamine, 9-(4-methylphenyl)- is 240.11 g/mol.
Where can I buy 9H-Purine-2,6-diamine, 9-(4-methylphenyl)-?
You can request a quote for 9H-Purine-2,6-diamine, 9-(4-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9H-Purine-2,6-diamine, 9-(4-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 9H-Purine-2,6-diamine, 9-(4-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.