ChemDiv1_012360
TL;DR: ChemDiv1_012360 (CAS 333764-34-4) is a chemical compound with molecular formula C18H13BrClF3N4O2 and molecular weight 487.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(4-bromophenyl)-3-chloro-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]-morpholin-4-ylmethanone
Also Known As: ChemDiv1_012360, BAS 00924410, BIM-0034853.P001, AB00098843-01, [5-(4-bromophenyl)-3-chloro-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]-morpholin-4-ylmethanone
| Molecular Formula | C18H13BrClF3N4O2 |
|---|---|
| Molecular Weight | 487.99 g/mol |
| LogP | 4.3034 |
| Topological Polar Surface Area | 59.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 487.98624 |
| Heavy Atoms | 29 |
| Complexity | 1079.3851 |
Chemical Identifiers
| CAS Number | 333764-34-4 |
|---|---|
| SMILES | C1COCCN1C(=O)C2=NN3C(=CC(=NC3=C2Cl)C4=CC=C(C=C4)Br)C(F)(F)F |
Product Overview
ChemDiv1_012360 (CAS 333764-34-4), with molecular formula C18H13BrClF3N4O2 and molecular weight 487.99 g/mol. IUPAC: [5-(4-bromophenyl)-3-chloro-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]-morpholin-4-ylmethanone.
Chemical Property Profile of ChemDiv1_012360
Property Insights of ChemDiv1_012360
The XLogP value of 4.3034 indicates that ChemDiv1_012360 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.73 Ų, ChemDiv1_012360 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_012360 has 0 hydrogen bond donor(s) and 4 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 ChemDiv1_012360?
The CAS number of ChemDiv1_012360 is 333764-34-4.
What is the molecular formula of ChemDiv1_012360?
The molecular formula of ChemDiv1_012360 is C18H13BrClF3N4O2.
What is the molecular weight of ChemDiv1_012360?
The molecular weight of ChemDiv1_012360 is 487.99 g/mol.
Where can I buy ChemDiv1_012360?
You can request a quote for ChemDiv1_012360 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_012360?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_012360 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.