RefChem:547254
TL;DR: RefChem:547254 (CAS 476481-85-3) is a chemical compound with molecular formula C19H24N4O3S and molecular weight 388.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2-hydroxypropylsulfanyl)-1,3-dimethyl-7-(3-phenylpropyl)purine-2,6-dione
Also Known As: Salor-int l217654-1ea, BAS 05968875, UPCMLD0ENAT5730364:001, 8-[(2-hydroxypropyl)sulfanyl]-1,3-dimethyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione, 8-((2-hydroxypropyl)thio)-1,3-dimethyl-7-(3-phenylpropyl)-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C19H24N4O3S |
|---|---|
| Molecular Weight | 388.16 g/mol |
| LogP | 1.5394 |
| Topological Polar Surface Area | 82.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 388.15692 |
| Heavy Atoms | 27 |
| Complexity | 1050.7325 |
Chemical Identifiers
| CAS Number | 476481-85-3 |
|---|---|
| SMILES | CC(CSC1=NC2=C(N1CCCC3=CC=CC=C3)C(=O)N(C(=O)N2C)C)O |
Product Overview
RefChem:547254 (CAS 476481-85-3), with molecular formula C19H24N4O3S and molecular weight 388.16 g/mol. IUPAC: 8-(2-hydroxypropylsulfanyl)-1,3-dimethyl-7-(3-phenylpropyl)purine-2,6-dione.
Chemical Property Profile of RefChem:547254
Property Insights of RefChem:547254
The XLogP value of 1.5394 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:547254. The TPSA of 82.05 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:547254. Following Lipinski's Rule of Five, RefChem:547254 has 1 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 RefChem:547254?
The CAS number of RefChem:547254 is 476481-85-3.
What is the molecular formula of RefChem:547254?
The molecular formula of RefChem:547254 is C19H24N4O3S.
What is the molecular weight of RefChem:547254?
The molecular weight of RefChem:547254 is 388.16 g/mol.
Where can I buy RefChem:547254?
You can request a quote for RefChem:547254 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:547254?
Yes, KEHONG BIO provides custom synthesis services for RefChem:547254 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.