BAS 06911064
TL;DR: BAS 06911064 (CAS 585552-80-3) is a chemical compound with molecular formula C14H13ClF3N5 and molecular weight 343.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-2-methylphenyl)-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]guanidine
Also Known As: BAS 06911064, 1-(3-chloro-2-methylphenyl)-3-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]guanidine, 1-(3-chloro-2-methylphenyl)-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]guanidine, 1-(3-chloro-2-methylphenyl)-3-(4-methyl-6-(trifluoromethyl)pyrimidin-2-yl)guanidine, {[(3-chloro-2-methylphenyl)amino]iminomethyl}[4-methyl-6-(trifluoromethyl)pyri midin-2-yl]amine
| Molecular Formula | C14H13ClF3N5 |
|---|---|
| Molecular Weight | 343.08 g/mol |
| LogP | 3.82394 |
| Topological Polar Surface Area | 76.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 343.08115 |
| Heavy Atoms | 23 |
| Complexity | 758.56335 |
Chemical Identifiers
| CAS Number | 585552-80-3 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)/N=C(\N)/NC2=C(C(=CC=C2)Cl)C)C(F)(F)F |
Product Overview
BAS 06911064 (CAS 585552-80-3), with molecular formula C14H13ClF3N5 and molecular weight 343.08 g/mol. IUPAC: 1-(3-chloro-2-methylphenyl)-2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]guanidine.
Chemical Property Profile of BAS 06911064
Property Insights of BAS 06911064
The XLogP value of 3.82394 indicates that BAS 06911064 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.19 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06911064. Following Lipinski's Rule of Five, BAS 06911064 has 2 hydrogen bond donor(s) and 3 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 06911064?
The CAS number of BAS 06911064 is 585552-80-3.
What is the molecular formula of BAS 06911064?
The molecular formula of BAS 06911064 is C14H13ClF3N5.
What is the molecular weight of BAS 06911064?
The molecular weight of BAS 06911064 is 343.08 g/mol.
Where can I buy BAS 06911064?
You can request a quote for BAS 06911064 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06911064?
Yes, KEHONG BIO provides custom synthesis services for BAS 06911064 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.