A2911/0122691
TL;DR: A2911/0122691 (CAS 606923-64-2) is a chemical compound with molecular formula C20H12F4N4O4 and molecular weight 448.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-fluoro-N-[2,4,6-trioxo-1-phenyl-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide
Also Known As: A2911/0122691, 4-fluoro-N-(2,4,6-trioxo-1-phenyl-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl)benzamide, 4-FLUORO-N-[2,4,6-TRIOXO-1-PHENYL-5-(TRIFLUOROMETHYL)-1H,2H,3H,4H,5H,6H,7H-PYRROLO[2,3-D]PYRIMIDIN-5-YL]BENZAMIDE, 4-fluoro-N-[2,4,6-trioxo-1-phenyl-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide, 4-fluoro-N-[2,4,6-trioxo-1-phenyl-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide
| Molecular Formula | C20H12F4N4O4 |
|---|---|
| Molecular Weight | 448.08 g/mol |
| LogP | 1.8046 |
| Topological Polar Surface Area | 113.06 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 448.07947 |
| Heavy Atoms | 32 |
| Complexity | 1347.2432 |
Chemical Identifiers
| CAS Number | 606923-64-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C3=C(C(=O)NC2=O)C(C(=O)N3)(C(F)(F)F)NC(=O)C4=CC=C(C=C4)F |
Product Overview
A2911/0122691 (CAS 606923-64-2), with molecular formula C20H12F4N4O4 and molecular weight 448.08 g/mol. IUPAC: 4-fluoro-N-[2,4,6-trioxo-1-phenyl-5-(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzamide.
Chemical Property Profile of A2911/0122691
Property Insights of A2911/0122691
The XLogP value of 1.8046 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2911/0122691. The TPSA of 113.06 Ų falls within the moderate polarity range, balancing permeability and solubility for A2911/0122691. Following Lipinski's Rule of Five, A2911/0122691 has 3 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 A2911/0122691?
The CAS number of A2911/0122691 is 606923-64-2.
What is the molecular formula of A2911/0122691?
The molecular formula of A2911/0122691 is C20H12F4N4O4.
What is the molecular weight of A2911/0122691?
The molecular weight of A2911/0122691 is 448.08 g/mol.
Where can I buy A2911/0122691?
You can request a quote for A2911/0122691 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2911/0122691?
Yes, KEHONG BIO provides custom synthesis services for A2911/0122691 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.