BAS 01122520
TL;DR: BAS 01122520 (CAS 313471-48-6) is a chemical compound with molecular formula C18H21N5O5S and molecular weight 419.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-2,6-dioxopurin-8-yl]sulfanylacetamide
Also Known As: BAS 01122520, 2-((7-(2-hydroxy-3-(o-tolyloxy)propyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)acetamide, AB00137700-02, F0403-0001, 2-[7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-2,6-dioxopurin-8-yl]sulfanylacetamide
| Molecular Formula | C18H21N5O5S |
|---|---|
| Molecular Weight | 419.13 g/mol |
| LogP | -0.25098 |
| Topological Polar Surface Area | 145.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 419.12634 |
| Heavy Atoms | 29 |
| Complexity | 1165.6387 |
Chemical Identifiers
| CAS Number | 313471-48-6 |
|---|---|
| SMILES | CC1=CC=CC=C1OCC(CN2C3=C(N=C2SCC(=O)N)N(C(=O)NC3=O)C)O |
Product Overview
BAS 01122520 (CAS 313471-48-6), with molecular formula C18H21N5O5S and molecular weight 419.13 g/mol. IUPAC: 2-[7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-2,6-dioxopurin-8-yl]sulfanylacetamide.
Chemical Property Profile of BAS 01122520
Property Insights of BAS 01122520
The XLogP value of -0.25098 indicates that BAS 01122520 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 145.23 Ų indicates high polarity, suggesting BAS 01122520 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 01122520 has 3 hydrogen bond donor(s) and 7 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 01122520?
The CAS number of BAS 01122520 is 313471-48-6.
What is the molecular formula of BAS 01122520?
The molecular formula of BAS 01122520 is C18H21N5O5S.
What is the molecular weight of BAS 01122520?
The molecular weight of BAS 01122520 is 419.13 g/mol.
Where can I buy BAS 01122520?
You can request a quote for BAS 01122520 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01122520?
Yes, KEHONG BIO provides custom synthesis services for BAS 01122520 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.