BAS 05099903
TL;DR: BAS 05099903 (CAS 577755-58-9) is a chemical compound with molecular formula C22H22N6OS and molecular weight 418.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(dimethylamino)phenyl]-2-[1-(4-methylphenyl)pyrazolo[5,4-d]pyrimidin-4-yl]sulfanylacetamide
Also Known As: BAS 05099903, N-(4-(dimethylamino)phenyl)-2-((1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)thio)acetamide, N-(4-dimethylaminophenyl)-2-[1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylacetamide, N-[4-(dimethylamino)phenyl]-2-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}acetamide
| Molecular Formula | C22H22N6OS |
|---|---|
| Molecular Weight | 418.16 g/mol |
| LogP | 3.92072 |
| Topological Polar Surface Area | 75.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.1576 |
| Heavy Atoms | 30 |
| Complexity | 1168.6897 |
Chemical Identifiers
| CAS Number | 577755-58-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC(=O)NC4=CC=C(C=C4)N(C)C |
Product Overview
BAS 05099903 (CAS 577755-58-9), with molecular formula C22H22N6OS and molecular weight 418.16 g/mol. IUPAC: N-[4-(dimethylamino)phenyl]-2-[1-(4-methylphenyl)pyrazolo[5,4-d]pyrimidin-4-yl]sulfanylacetamide.
Chemical Property Profile of BAS 05099903
Property Insights of BAS 05099903
The XLogP value of 3.92072 indicates that BAS 05099903 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.94 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05099903. Following Lipinski's Rule of Five, BAS 05099903 has 1 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 05099903?
The CAS number of BAS 05099903 is 577755-58-9.
What is the molecular formula of BAS 05099903?
The molecular formula of BAS 05099903 is C22H22N6OS.
What is the molecular weight of BAS 05099903?
The molecular weight of BAS 05099903 is 418.16 g/mol.
Where can I buy BAS 05099903?
You can request a quote for BAS 05099903 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05099903?
Yes, KEHONG BIO provides custom synthesis services for BAS 05099903 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.