RS 100329
TL;DR: RS 100329 (CAS 232953-52-5) is a chemical compound with molecular formula C20H25F3N4O3 and molecular weight 426.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3-[3-[4-[2-(2,2,2-trifluoroethoxy)phenyl]piperazin-1-yl]propyl]-1H-pyrimidine-2,4-dione
Also Known As: RS 100329, SID:92098552, J1.546.598K, 5-methyl-3-[3-[4-[2-(2,2,2-trifluoroethoxy)phenyl]piperazin-1-yl]propyl]-1H-pyrimidine-2,4-dione, BRD-K08640512-003-01-5
| Molecular Formula | C20H25F3N4O3 |
|---|---|
| Molecular Weight | 426.19 g/mol |
| LogP | 1.99842 |
| Topological Polar Surface Area | 70.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 426.18787 |
| Heavy Atoms | 30 |
| Complexity | 962.7446 |
Chemical Identifiers
| CAS Number | 232953-52-5 |
|---|---|
| SMILES | CC1=CNC(=O)N(C1=O)CCCN2CCN(CC2)C3=CC=CC=C3OCC(F)(F)F |
Product Overview
RS 100329 (CAS 232953-52-5), with molecular formula C20H25F3N4O3 and molecular weight 426.19 g/mol. IUPAC: 5-methyl-3-[3-[4-[2-(2,2,2-trifluoroethoxy)phenyl]piperazin-1-yl]propyl]-1H-pyrimidine-2,4-dione.
Chemical Property Profile of RS 100329
Property Insights of RS 100329
The XLogP value of 1.99842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RS 100329. The TPSA of 70.57 Ų falls within the moderate polarity range, balancing permeability and solubility for RS 100329. Following Lipinski's Rule of Five, RS 100329 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 RS 100329?
The CAS number of RS 100329 is 232953-52-5.
What is the molecular formula of RS 100329?
The molecular formula of RS 100329 is C20H25F3N4O3.
What is the molecular weight of RS 100329?
The molecular weight of RS 100329 is 426.19 g/mol.
Where can I buy RS 100329?
You can request a quote for RS 100329 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RS 100329?
Yes, KEHONG BIO provides custom synthesis services for RS 100329 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.