BAS 07529121
TL;DR: BAS 07529121 (CAS 669745-84-0) is a chemical compound with molecular formula C18H16F3N5OS and molecular weight 407.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-ethoxyphenyl)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]guanidine
Also Known As: BAS 07529121, SDCCGSBI-0091365.P001, 1-(4-ethoxyphenyl)-3-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]guanidine, 1-(4-ethoxyphenyl)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]guanidine, 1-(4-ethoxyphenyl)-3-(4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl)guanidine
| Molecular Formula | C18H16F3N5OS |
|---|---|
| Molecular Weight | 407.10 g/mol |
| LogP | 4.6809 |
| Topological Polar Surface Area | 85.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 407.10275 |
| Heavy Atoms | 28 |
| Complexity | 956.3525 |
Chemical Identifiers
| CAS Number | 669745-84-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N/C(=N/C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CS3)/N |
Product Overview
BAS 07529121 (CAS 669745-84-0), with molecular formula C18H16F3N5OS and molecular weight 407.10 g/mol. IUPAC: 1-(4-ethoxyphenyl)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]guanidine.
Chemical Property Profile of BAS 07529121
Property Insights of BAS 07529121
The XLogP value of 4.6809 indicates that BAS 07529121 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.42 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07529121. Following Lipinski's Rule of Five, BAS 07529121 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 07529121?
The CAS number of BAS 07529121 is 669745-84-0.
What is the molecular formula of BAS 07529121?
The molecular formula of BAS 07529121 is C18H16F3N5OS.
What is the molecular weight of BAS 07529121?
The molecular weight of BAS 07529121 is 407.10 g/mol.
Where can I buy BAS 07529121?
You can request a quote for BAS 07529121 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07529121?
Yes, KEHONG BIO provides custom synthesis services for BAS 07529121 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.