mesitylmethyl 9H-purin-6-yl sulfide
TL;DR: mesitylmethyl 9H-purin-6-yl sulfide (CAS 724450-89-9) is a chemical compound with molecular formula C15H16N4S and molecular weight 284.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(2,4,6-trimethylphenyl)methylsulfanyl]-7H-purine
Also Known As: mesitylmethyl 9H-purin-6-yl sulfide, BAS 08304457, 6-[(2,4,6-trimethylphenyl)methylthio]purine, 6-(2,4,6-Trimethyl-benzylsulfanyl)-9H-purine, 6-[(2,4,6-trimethylbenzyl)sulfanyl]-9H-purine
| Molecular Formula | C15H16N4S |
|---|---|
| Molecular Weight | 284.11 g/mol |
| LogP | 3.57046 |
| Topological Polar Surface Area | 54.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.10956 |
| Heavy Atoms | 20 |
| Complexity | 740.40454 |
Chemical Identifiers
| CAS Number | 724450-89-9 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)CSC2=NC=NC3=C2NC=N3)C |
Product Overview
mesitylmethyl 9H-purin-6-yl sulfide (CAS 724450-89-9), with molecular formula C15H16N4S and molecular weight 284.11 g/mol. IUPAC: 6-[(2,4,6-trimethylphenyl)methylsulfanyl]-7H-purine.
Chemical Property Profile of mesitylmethyl 9H-purin-6-yl sulfide
Property Insights of mesitylmethyl 9H-purin-6-yl sulfide
The XLogP value of 3.57046 indicates that mesitylmethyl 9H-purin-6-yl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.46 Ų, mesitylmethyl 9H-purin-6-yl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, mesitylmethyl 9H-purin-6-yl sulfide 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 mesitylmethyl 9H-purin-6-yl sulfide?
The CAS number of mesitylmethyl 9H-purin-6-yl sulfide is 724450-89-9.
What is the molecular formula of mesitylmethyl 9H-purin-6-yl sulfide?
The molecular formula of mesitylmethyl 9H-purin-6-yl sulfide is C15H16N4S.
What is the molecular weight of mesitylmethyl 9H-purin-6-yl sulfide?
The molecular weight of mesitylmethyl 9H-purin-6-yl sulfide is 284.11 g/mol.
Where can I buy mesitylmethyl 9H-purin-6-yl sulfide?
You can request a quote for mesitylmethyl 9H-purin-6-yl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for mesitylmethyl 9H-purin-6-yl sulfide?
Yes, KEHONG BIO provides custom synthesis services for mesitylmethyl 9H-purin-6-yl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.