![N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide structure](/static/products/866/866041-31-8.webp)
N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide
TL;DR: N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide (CAS 866041-31-8) is a chemical compound with molecular formula C18H12FN3O2 and molecular weight 321.09137 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzamide
Also Known As: N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide, N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzamide, N-{5H-chromeno[4,3-d]pyrimidin-2-yl}-4-fluorobenzamide, 5X-0944, N-(5H-[1]benzopyrano[4,3-d]pyrimidin-2-yl)-4-fluorobenzamide
Technical Specifications
| Molecular Formula | C18H12FN3O2 |
| Molecular Weight | 321.09137 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 64.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.09137 Da |
| Heavy Atoms | 24 |
| Complexity | 456.0 |
| SMILES | C1C2=CN=C(N=C2C3=CC=CC=C3O1)NC(=O)C4=CC=C(C=C4)F |
| InChIKey | WQHQAQVHEREJDF-UHFFFAOYSA-N |
Chemical Property Profile of N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide
Property Insights of N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide. The TPSA of 64.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide. Following Lipinski's Rule of Five, N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide?
The CAS number of N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide is 866041-31-8.
What is the molecular formula of N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide?
The molecular formula of N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide is C18H12FN3O2.
What is the molecular weight of N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide?
The molecular weight of N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide is 321.09137 g/mol.
Where can I buy N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide?
You can request a quote for N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide?
Yes, CoreyChem provides custom synthesis services for N-(5H-chromeno[4,3-d]pyrimidin-2-yl)-4-fluorobenzenecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.