BAS 00512115
TL;DR: BAS 00512115 (CAS 370075-44-8) is a chemical compound with molecular formula C24H42N4O3S and molecular weight 466.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hexadecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione
Also Known As: BAS 00512115, 7-hexadecyl-8-[(2-hydroxyethyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione, 7-hexadecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione, 7-hexadecyl-8-((2-hydroxyethyl)thio)-3-methyl-1H-purine-2,6(3H,7H)-dione, 7-Hexadecyl-8-(2-hydroxy-ethylsulfanyl)-3-methyl-3,7-dihydro-purine-2,6-dione
| Molecular Formula | C24H42N4O3S |
|---|---|
| Molecular Weight | 466.30 g/mol |
| LogP | 4.989 |
| Topological Polar Surface Area | 92.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 18 |
| Exact Mass | 466.29776 |
| Heavy Atoms | 32 |
| Complexity | 903.00696 |
Chemical Identifiers
| CAS Number | 370075-44-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCN1C2=C(N=C1SCCO)N(C(=O)NC2=O)C |
Product Overview
BAS 00512115 (CAS 370075-44-8), with molecular formula C24H42N4O3S and molecular weight 466.30 g/mol. IUPAC: 7-hexadecyl-8-(2-hydroxyethylsulfanyl)-3-methylpurine-2,6-dione.
Chemical Property Profile of BAS 00512115
Property Insights of BAS 00512115
The XLogP value of 4.989 indicates that BAS 00512115 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.91 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00512115. Following Lipinski's Rule of Five, BAS 00512115 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 BAS 00512115?
The CAS number of BAS 00512115 is 370075-44-8.
What is the molecular formula of BAS 00512115?
The molecular formula of BAS 00512115 is C24H42N4O3S.
What is the molecular weight of BAS 00512115?
The molecular weight of BAS 00512115 is 466.30 g/mol.
Where can I buy BAS 00512115?
You can request a quote for BAS 00512115 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00512115?
Yes, KEHONG BIO provides custom synthesis services for BAS 00512115 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.