F1874-0771
TL;DR: F1874-0771 (CAS 872860-39-4) is a chemical compound with molecular formula C19H20ClN5OS and molecular weight 401.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(azepan-1-yl)-2-[1-(3-chlorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]sulfanylethanone
Also Known As: F1874-0771, 1-(azepan-1-yl)-2-{[1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}ethan-1-one, 1-(azepan-1-yl)-2-((1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)thio)ethanone, 1-(azepan-1-yl)-2-[1-(3-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylethanone
| Molecular Formula | C19H20ClN5OS |
|---|---|
| Molecular Weight | 401.11 g/mol |
| LogP | 3.9636 |
| Topological Polar Surface Area | 63.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 401.1077 |
| Heavy Atoms | 27 |
| Complexity | 952.1779 |
Chemical Identifiers
| CAS Number | 872860-39-4 |
|---|---|
| SMILES | C1CCCN(CC1)C(=O)CSC2=NC=NC3=C2C=NN3C4=CC(=CC=C4)Cl |
Product Overview
F1874-0771 (CAS 872860-39-4), with molecular formula C19H20ClN5OS and molecular weight 401.11 g/mol. IUPAC: 1-(azepan-1-yl)-2-[1-(3-chlorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]sulfanylethanone.
Chemical Property Profile of F1874-0771
Property Insights of F1874-0771
The XLogP value of 3.9636 indicates that F1874-0771 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.91 Ų falls within the moderate polarity range, balancing permeability and solubility for F1874-0771. Following Lipinski's Rule of Five, F1874-0771 has 0 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 F1874-0771?
The CAS number of F1874-0771 is 872860-39-4.
What is the molecular formula of F1874-0771?
The molecular formula of F1874-0771 is C19H20ClN5OS.
What is the molecular weight of F1874-0771?
The molecular weight of F1874-0771 is 401.11 g/mol.
Where can I buy F1874-0771?
You can request a quote for F1874-0771 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1874-0771?
Yes, KEHONG BIO provides custom synthesis services for F1874-0771 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.