AB00431330-09
TL;DR: AB00431330-09 (CAS 893339-21-4) is a chemical compound with molecular formula C18H21F3N4O4S and molecular weight 446.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,6-trimethyl-5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylpyrimidine-2,4-dione
Also Known As: AB00431330-09, F1844-0208, 1,3,6-trimethyl-5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylpyrimidine-2,4-dione, 1,3,6-trimethyl-5-((4-(3-(trifluoromethyl)phenyl)piperazin-1-yl)sulfonyl)pyrimidine-2,4(1H,3H)-dione, 1,3,6-trimethyl-5-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}sulfonyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
| Molecular Formula | C18H21F3N4O4S |
|---|---|
| Molecular Weight | 446.12 g/mol |
| LogP | 0.92212 |
| Topological Polar Surface Area | 84.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 446.12357 |
| Heavy Atoms | 30 |
| Complexity | 1193.378 |
Chemical Identifiers
| CAS Number | 893339-21-4 |
|---|---|
| SMILES | CC1=C(C(=O)N(C(=O)N1C)C)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F |
Product Overview
AB00431330-09 (CAS 893339-21-4), with molecular formula C18H21F3N4O4S and molecular weight 446.12 g/mol. IUPAC: 1,3,6-trimethyl-5-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]sulfonylpyrimidine-2,4-dione.
Chemical Property Profile of AB00431330-09
Property Insights of AB00431330-09
The XLogP value of 0.92212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00431330-09. The TPSA of 84.62 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00431330-09. Following Lipinski's Rule of Five, AB00431330-09 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 AB00431330-09?
The CAS number of AB00431330-09 is 893339-21-4.
What is the molecular formula of AB00431330-09?
The molecular formula of AB00431330-09 is C18H21F3N4O4S.
What is the molecular weight of AB00431330-09?
The molecular weight of AB00431330-09 is 446.12 g/mol.
Where can I buy AB00431330-09?
You can request a quote for AB00431330-09 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00431330-09?
Yes, KEHONG BIO provides custom synthesis services for AB00431330-09 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.