4H-037
TL;DR: 4H-037 (CAS 338420-94-3) is a chemical compound with molecular formula C19H12ClF3N4O and molecular weight 404.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine
Also Known As: 4H-037, 6-(3-Chloro-5-(trifluoromethyl)-2-pyridinyl)-3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine, 6-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine, 6-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine, 3-chloro-2-[3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidin-6-yl]-5-(trifluoromethyl)pyridine
| Molecular Formula | C19H12ClF3N4O |
|---|---|
| Molecular Weight | 404.07 g/mol |
| LogP | 5.1391 |
| Topological Polar Surface Area | 52.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 404.0652 |
| Heavy Atoms | 28 |
| Complexity | 1156.2678 |
Chemical Identifiers
| CAS Number | 338420-94-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C3N=CC(=CN3N=C2)C4=C(C=C(C=N4)C(F)(F)F)Cl |
Product Overview
4H-037 (CAS 338420-94-3), with molecular formula C19H12ClF3N4O and molecular weight 404.07 g/mol. IUPAC: 6-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-3-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine.
Chemical Property Profile of 4H-037
Property Insights of 4H-037
The XLogP value of 5.1391 indicates that 4H-037 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.31 Ų, 4H-037 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-037 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4H-037?
The CAS number of 4H-037 is 338420-94-3.
What is the molecular formula of 4H-037?
The molecular formula of 4H-037 is C19H12ClF3N4O.
What is the molecular weight of 4H-037?
The molecular weight of 4H-037 is 404.07 g/mol.
Where can I buy 4H-037?
You can request a quote for 4H-037 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-037?
Yes, KEHONG BIO provides custom synthesis services for 4H-037 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.