DX44GS85HK
TL;DR: DX44GS85HK (CAS 143782-63-2) is a chemical compound with molecular formula C15H11F3N4O2 and molecular weight 336.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(cyanomethyl)-4,4-dimethyl-2,5-dioxoimidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile
Also Known As: 3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-2,4-dioxo-1-imidazolidineacetonitrile, 4-[3-(cyanomethyl)-4,4-dimethyl-2,5-dioxoimidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile, 1-Imidazolidineacetonitrile, 3-[4-cyano-3-(trifluoromethyl)phenyl]-5,5-dimethyl-2,4-dioxo-, 4-(3-(cyanomethyl)-4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile, 1-(Cyanomethyl)-3-[3-(trifluoromethyl)-4-cyanophenyl]-5,5-dimethyl-2,4-imidazolidinedione
| Molecular Formula | C15H11F3N4O2 |
|---|---|
| Molecular Weight | 336.08 g/mol |
| LogP | 2.64786 |
| Topological Polar Surface Area | 88.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 336.0834 |
| Heavy Atoms | 24 |
| Complexity | 802.4079 |
Chemical Identifiers
| CAS Number | 143782-63-2 |
|---|---|
| SMILES | CC1(C(=O)N(C(=O)N1CC#N)C2=CC(=C(C=C2)C#N)C(F)(F)F)C |
Product Overview
DX44GS85HK (CAS 143782-63-2), with molecular formula C15H11F3N4O2 and molecular weight 336.08 g/mol. IUPAC: 4-[3-(cyanomethyl)-4,4-dimethyl-2,5-dioxoimidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile.
Chemical Property Profile of DX44GS85HK
Property Insights of DX44GS85HK
The XLogP value of 2.64786 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DX44GS85HK. The TPSA of 88.2 Ų falls within the moderate polarity range, balancing permeability and solubility for DX44GS85HK. Following Lipinski's Rule of Five, DX44GS85HK has 0 hydrogen bond donor(s) and 4 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 DX44GS85HK?
The CAS number of DX44GS85HK is 143782-63-2.
What is the molecular formula of DX44GS85HK?
The molecular formula of DX44GS85HK is C15H11F3N4O2.
What is the molecular weight of DX44GS85HK?
The molecular weight of DX44GS85HK is 336.08 g/mol.
Where can I buy DX44GS85HK?
You can request a quote for DX44GS85HK directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DX44GS85HK?
Yes, KEHONG BIO provides custom synthesis services for DX44GS85HK and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.