Bionet1_000781
TL;DR: Bionet1_000781 (CAS 321432-06-8) is a chemical compound with molecular formula C14H13ClF3N5O2 and molecular weight 375.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-1H-pyrimidine-2,4-dione
Also Known As: Bionet1_000781, 1H-914, 5-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2,4(1H,3H)-pyrimidinedione, 5-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-1H-pyrimidine-2,4-dione, 5-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}-1,2,3,4-tetrahydropyrimidine-2,4-dione
| Molecular Formula | C14H13ClF3N5O2 |
|---|---|
| Molecular Weight | 375.07 g/mol |
| LogP | 1.457 |
| Topological Polar Surface Area | 85.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 375.07098 |
| Heavy Atoms | 25 |
| Complexity | 887.01154 |
Chemical Identifiers
| CAS Number | 321432-06-8 |
|---|---|
| SMILES | C1CN(CCN1C2=CNC(=O)NC2=O)C3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
Bionet1_000781 (CAS 321432-06-8), with molecular formula C14H13ClF3N5O2 and molecular weight 375.07 g/mol. IUPAC: 5-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-1H-pyrimidine-2,4-dione.
Chemical Property Profile of Bionet1_000781
Property Insights of Bionet1_000781
The XLogP value of 1.457 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_000781. The TPSA of 85.09 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_000781. Following Lipinski's Rule of Five, Bionet1_000781 has 2 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 Bionet1_000781?
The CAS number of Bionet1_000781 is 321432-06-8.
What is the molecular formula of Bionet1_000781?
The molecular formula of Bionet1_000781 is C14H13ClF3N5O2.
What is the molecular weight of Bionet1_000781?
The molecular weight of Bionet1_000781 is 375.07 g/mol.
Where can I buy Bionet1_000781?
You can request a quote for Bionet1_000781 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000781?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.