ChemDiv1_012582
TL;DR: ChemDiv1_012582 (CAS 333765-57-4) is a chemical compound with molecular formula C20H18Cl2F3N5O2 and molecular weight 487.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dichlorophenyl)-N-(2-morpholin-4-ylethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: ChemDiv1_012582, BAS 00924556, BIM-0034564.P001, 5-(3,4-dichlorophenyl)-N-(2-morpholin-4-ylethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, 5-(3,4-dichlorophenyl)-N-[2-(morpholin-4-yl)ethyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
| Molecular Formula | C20H18Cl2F3N5O2 |
|---|---|
| Molecular Weight | 487.08 g/mol |
| LogP | 3.7839 |
| Topological Polar Surface Area | 71.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 487.07898 |
| Heavy Atoms | 32 |
| Complexity | 1146.201 |
Chemical Identifiers
| CAS Number | 333765-57-4 |
|---|---|
| SMILES | C1COCCN1CCNC(=O)C2=NN3C(=CC(=NC3=C2)C4=CC(=C(C=C4)Cl)Cl)C(F)(F)F |
Product Overview
ChemDiv1_012582 (CAS 333765-57-4), with molecular formula C20H18Cl2F3N5O2 and molecular weight 487.08 g/mol. IUPAC: 5-(3,4-dichlorophenyl)-N-(2-morpholin-4-ylethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of ChemDiv1_012582
Property Insights of ChemDiv1_012582
The XLogP value of 3.7839 indicates that ChemDiv1_012582 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.76 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_012582. Following Lipinski's Rule of Five, ChemDiv1_012582 has 1 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 ChemDiv1_012582?
The CAS number of ChemDiv1_012582 is 333765-57-4.
What is the molecular formula of ChemDiv1_012582?
The molecular formula of ChemDiv1_012582 is C20H18Cl2F3N5O2.
What is the molecular weight of ChemDiv1_012582?
The molecular weight of ChemDiv1_012582 is 487.08 g/mol.
Where can I buy ChemDiv1_012582?
You can request a quote for ChemDiv1_012582 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_012582?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_012582 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.