A2992/0126086
TL;DR: A2992/0126086 (CAS 606923-70-0) is a chemical compound with molecular formula C21H13F7N4O2 and molecular weight 486.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-benzyl-1-(4-fluorophenyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
Also Known As: A2992/0126086, 7-benzyl-1-(4-fluorophenyl)-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 7-benzyl-1-(4-fluorophenyl)-4-hydroxy-5,5-bis(trifluoromethyl)-5,8-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one, 7-BENZYL-1-(4-FLUOROPHENYL)-5,5-BIS(TRIFLUOROMETHYL)-1H,2H,3H,4H,5H,8H-PYRIMIDO[4,5-D][1,3]DIAZINE-2,4-DIONE, 7-benzyl-1-(4-fluorophenyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione
| Molecular Formula | C21H13F7N4O2 |
|---|---|
| Molecular Weight | 486.09 g/mol |
| LogP | 4.0515 |
| Topological Polar Surface Area | 79.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 486.09268 |
| Heavy Atoms | 34 |
| Complexity | 1357.9515 |
Chemical Identifiers
| CAS Number | 606923-70-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=NC(C3=C(N2)N(C(=O)NC3=O)C4=CC=C(C=C4)F)(C(F)(F)F)C(F)(F)F |
Product Overview
A2992/0126086 (CAS 606923-70-0), with molecular formula C21H13F7N4O2 and molecular weight 486.09 g/mol. IUPAC: 7-benzyl-1-(4-fluorophenyl)-5,5-bis(trifluoromethyl)-8H-pyrimido[4,5-d]pyrimidine-2,4-dione.
Chemical Property Profile of A2992/0126086
Property Insights of A2992/0126086
The XLogP value of 4.0515 indicates that A2992/0126086 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.25 Ų falls within the moderate polarity range, balancing permeability and solubility for A2992/0126086. Following Lipinski's Rule of Five, A2992/0126086 has 2 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 A2992/0126086?
The CAS number of A2992/0126086 is 606923-70-0.
What is the molecular formula of A2992/0126086?
The molecular formula of A2992/0126086 is C21H13F7N4O2.
What is the molecular weight of A2992/0126086?
The molecular weight of A2992/0126086 is 486.09 g/mol.
Where can I buy A2992/0126086?
You can request a quote for A2992/0126086 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2992/0126086?
Yes, KEHONG BIO provides custom synthesis services for A2992/0126086 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.