BAS 01107461
TL;DR: BAS 01107461 (CAS 303970-67-4) is a chemical compound with molecular formula C24H28N4O4S and molecular weight 468.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-hydroxy-3-naphthalen-1-yloxypropyl)-3-methyl-8-(3-methylbutylsulfanyl)purine-2,6-dione
Also Known As: BAS 01107461, 7-[2-hydroxy-3-(naphthalen-1-yloxy)propyl]-3-methyl-8-[(3-methylbutyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione, 6-hydroxy-7-[2-hydroxy-3-(naphthalen-1-yloxy)propyl]-3-methyl-8-[(3-methylbutyl)sulfanyl]-3,7-dihydro-2H-purin-2-one, 7-(2-hydroxy-3-(naphthalen-1-yloxy)propyl)-8-(isopentylthio)-3-methyl-1H-purine-2,6(3H,7H)-dione, 7-(2-hydroxy-3-naphthalen-1-yloxypropyl)-3-methyl-8-(3-methylbutylsulfanyl)purine-2,6-dione
| Molecular Formula | C24H28N4O4S |
|---|---|
| Molecular Weight | 468.18 g/mol |
| LogP | 3.1546 |
| Topological Polar Surface Area | 102.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 468.18314 |
| Heavy Atoms | 33 |
| Complexity | 1383.745 |
Chemical Identifiers
| CAS Number | 303970-67-4 |
|---|---|
| SMILES | CC(C)CCSC1=NC2=C(N1CC(COC3=CC=CC4=CC=CC=C43)O)C(=O)NC(=O)N2C |
Product Overview
BAS 01107461 (CAS 303970-67-4), with molecular formula C24H28N4O4S and molecular weight 468.18 g/mol. IUPAC: 7-(2-hydroxy-3-naphthalen-1-yloxypropyl)-3-methyl-8-(3-methylbutylsulfanyl)purine-2,6-dione.
Chemical Property Profile of BAS 01107461
Property Insights of BAS 01107461
The XLogP value of 3.1546 indicates that BAS 01107461 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.14 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01107461. Following Lipinski's Rule of Five, BAS 01107461 has 2 hydrogen bond donor(s) and 6 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 01107461?
The CAS number of BAS 01107461 is 303970-67-4.
What is the molecular formula of BAS 01107461?
The molecular formula of BAS 01107461 is C24H28N4O4S.
What is the molecular weight of BAS 01107461?
The molecular weight of BAS 01107461 is 468.18 g/mol.
Where can I buy BAS 01107461?
You can request a quote for BAS 01107461 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01107461?
Yes, KEHONG BIO provides custom synthesis services for BAS 01107461 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.