BAS 04840223
TL;DR: BAS 04840223 (CAS 346451-05-6) is a chemical compound with molecular formula C22H27N5O4S2 and molecular weight 489.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butan-2-yl-5-[(1-butan-2-yl-6-hydroxy-4-oxo-2-sulfanylidenepyrimidin-5-yl)-pyridin-2-ylmethyl]-6-hydroxy-2-sulfanylidenepyrimidin-4-one
Also Known As: BAS 04840223, 5,5'-(pyridin-2-ylmethanediyl)bis[1-(butan-2-yl)-6-hydroxy-2-sulfanylpyrimidin-4(1H)-one], 5,5'-(pyridin-2-ylmethylene)bis(1-(sec-butyl)-6-hydroxy-2-mercaptopyrimidin-4(1H)-one), 1-butan-2-yl-5-[(1-butan-2-yl-6-hydroxy-4-oxo-2-sulfanylidenepyrimidin-5-yl)-pyridin-2-ylmethyl]-6-hydroxy-2-sulfanylidenepyrimidin-4-one, 6-hydroxy-5-{[6-hydroxy-1-(methylpropyl)-4-oxo-2-thioxo(1,3-dihydropyrimidin-5 -yl)]-2-pyridylmethyl}-1-(methylpropyl)-2-thioxo-1,3-dihydropyrimidin-4-one
| Molecular Formula | C22H27N5O4S2 |
|---|---|
| Molecular Weight | 489.15 g/mol |
| LogP | 4.05358 |
| Topological Polar Surface Area | 128.93 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 489.15045 |
| Heavy Atoms | 33 |
| Complexity | 1303.611 |
Chemical Identifiers
| CAS Number | 346451-05-6 |
|---|---|
| SMILES | CCC(C)N1C(=C(C(=O)NC1=S)C(C2=CC=CC=N2)C3=C(N(C(=S)NC3=O)C(C)CC)O)O |
Product Overview
BAS 04840223 (CAS 346451-05-6), with molecular formula C22H27N5O4S2 and molecular weight 489.15 g/mol. IUPAC: 1-butan-2-yl-5-[(1-butan-2-yl-6-hydroxy-4-oxo-2-sulfanylidenepyrimidin-5-yl)-pyridin-2-ylmethyl]-6-hydroxy-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of BAS 04840223
Property Insights of BAS 04840223
The XLogP value of 4.05358 indicates that BAS 04840223 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.93 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04840223. Following Lipinski's Rule of Five, BAS 04840223 has 4 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 04840223?
The CAS number of BAS 04840223 is 346451-05-6.
What is the molecular formula of BAS 04840223?
The molecular formula of BAS 04840223 is C22H27N5O4S2.
What is the molecular weight of BAS 04840223?
The molecular weight of BAS 04840223 is 489.15 g/mol.
Where can I buy BAS 04840223?
You can request a quote for BAS 04840223 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04840223?
Yes, KEHONG BIO provides custom synthesis services for BAS 04840223 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.