BRN 0847310
TL;DR: BRN 0847310 (CAS 73832-10-7) is a chemical compound with molecular formula C16H11F4N3O and molecular weight 337.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-2-(fluoromethyl)-3-[2-(trifluoromethyl)phenyl]quinazolin-4-one
Also Known As: 5-25-15-00103 (Beilstein Handbook Reference), 4(3H)-Quinazolinone, 6-amino-2-fluoromethyl-3-(alpha,alpha,alpha-trifluoro-o-tolyl)-, 6-Amino-2-fluoromethyl-3-(o-trifluoromethylphenyl)-4(3H)-quinazolinone, 6-Amino-2-fluoromethyl-3-(alpha,alpha,alpha-trifluoro-o-tolyl)-4(3H)-quinazolinone, 6-Amino-2-(fluoromethyl)-3-[2-(trifluoromethyl)phenyl]quinazolin-4(3H)-one
| Molecular Formula | C16H11F4N3O |
|---|---|
| Molecular Weight | 337.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 58.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 337.08383 |
| Heavy Atoms | 24 |
| Complexity | 522.0 |
Chemical Identifiers
| CAS Number | 73832-10-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(F)(F)F)N2C(=NC3=C(C2=O)C=C(C=C3)N)CF |
| InChIKey | PZYWPLWYRPOKGM-UHFFFAOYSA-N |
Product Overview
BRN 0847310 (CAS 73832-10-7), with molecular formula C16H11F4N3O and molecular weight 337.08 g/mol. IUPAC: 6-amino-2-(fluoromethyl)-3-[2-(trifluoromethyl)phenyl]quinazolin-4-one.
Chemical Property Profile of BRN 0847310
Property Insights of BRN 0847310
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BRN 0847310. With a topological polar surface area (TPSA) of 58.7 Ų, BRN 0847310 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BRN 0847310 has 1 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 BRN 0847310?
The CAS number of BRN 0847310 is 73832-10-7.
What is the molecular formula of BRN 0847310?
The molecular formula of BRN 0847310 is C16H11F4N3O.
What is the molecular weight of BRN 0847310?
The molecular weight of BRN 0847310 is 337.08 g/mol.
Where can I buy BRN 0847310?
You can request a quote for BRN 0847310 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRN 0847310?
Yes, KEHONG BIO provides custom synthesis services for BRN 0847310 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.