H4R antagonist 3
TL;DR: H4R antagonist 3 (CAS 1003091-20-0) is a chemical compound with molecular formula C19H21ClN4S and molecular weight 372.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-N-methyl-N-(1-methylpiperidin-4-yl)thieno[2,3-d]pyrimidin-4-amine
Also Known As: H4R antagonist 3, 5-(4-chlorophenyl)-N-methyl-N-(1-methylpiperidin-4-yl)thieno[2,3-d]pyrimidin-4-amine, N-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]-N,1-dimethylpiperidin-4-amine
| Molecular Formula | C19H21ClN4S |
|---|---|
| Molecular Weight | 372.12 g/mol |
| LogP | 4.5421 |
| Topological Polar Surface Area | 32.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.11755 |
| Heavy Atoms | 25 |
| Complexity | 868.7664 |
Chemical Identifiers
| CAS Number | 1003091-20-0 |
|---|---|
| SMILES | CN1CCC(CC1)N(C)C2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Cl |
Product Overview
H4R antagonist 3 (CAS 1003091-20-0), with molecular formula C19H21ClN4S and molecular weight 372.12 g/mol. IUPAC: 5-(4-chlorophenyl)-N-methyl-N-(1-methylpiperidin-4-yl)thieno[2,3-d]pyrimidin-4-amine.
Chemical Property Profile of H4R antagonist 3
Property Insights of H4R antagonist 3
The XLogP value of 4.5421 indicates that H4R antagonist 3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.26 Ų, H4R antagonist 3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, H4R antagonist 3 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 H4R antagonist 3?
The CAS number of H4R antagonist 3 is 1003091-20-0.
What is the molecular formula of H4R antagonist 3?
The molecular formula of H4R antagonist 3 is C19H21ClN4S.
What is the molecular weight of H4R antagonist 3?
The molecular weight of H4R antagonist 3 is 372.12 g/mol.
Where can I buy H4R antagonist 3?
You can request a quote for H4R antagonist 3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for H4R antagonist 3?
Yes, KEHONG BIO provides custom synthesis services for H4R antagonist 3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.