ChemDiv1_004083
TL;DR: ChemDiv1_004083 (CAS 334499-39-7) is a chemical compound with molecular formula C22H23ClF3N5O3 and molecular weight 497.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-5-(4-methoxyphenyl)-N-(3-morpholin-4-ylpropyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: ChemDiv1_004083, BAS 01058572, 3-chloro-5-(4-methoxyphenyl)-N-(3-morpholin-4-ylpropyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, 3-chloro-5-(4-methoxyphenyl)-N-[3-(morpholin-4-yl)propyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, [3-chloro-5-(4-methoxyphenyl)-7-(trifluoromethyl)(8-hydropyrazolo[1,5-a]pyrimi din-2-yl)]-N-(3-morpholin-4-ylpropyl)carboxamide
| Molecular Formula | C22H23ClF3N5O3 |
|---|---|
| Molecular Weight | 497.14 g/mol |
| LogP | 3.5292 |
| Topological Polar Surface Area | 80.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 497.14417 |
| Heavy Atoms | 34 |
| Complexity | 1161.2869 |
Chemical Identifiers
| CAS Number | 334499-39-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NC3=C(C(=NN3C(=C2)C(F)(F)F)C(=O)NCCCN4CCOCC4)Cl |
Product Overview
ChemDiv1_004083 (CAS 334499-39-7), with molecular formula C22H23ClF3N5O3 and molecular weight 497.14 g/mol. IUPAC: 3-chloro-5-(4-methoxyphenyl)-N-(3-morpholin-4-ylpropyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of ChemDiv1_004083
Property Insights of ChemDiv1_004083
The XLogP value of 3.5292 indicates that ChemDiv1_004083 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.99 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_004083. Following Lipinski's Rule of Five, ChemDiv1_004083 has 1 hydrogen bond donor(s) and 6 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_004083?
The CAS number of ChemDiv1_004083 is 334499-39-7.
What is the molecular formula of ChemDiv1_004083?
The molecular formula of ChemDiv1_004083 is C22H23ClF3N5O3.
What is the molecular weight of ChemDiv1_004083?
The molecular weight of ChemDiv1_004083 is 497.14 g/mol.
Where can I buy ChemDiv1_004083?
You can request a quote for ChemDiv1_004083 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_004083?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_004083 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.