![(E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione structure](/static/products/674/674351-11-2.webp)
(E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
TL;DR: (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione (CAS 674351-11-2) is a chemical compound with molecular formula C18H13FN4O3 and molecular weight 352.09717 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(E)-(2-fluorophenyl)methylideneamino]-9-methoxy-1,5-dihydropyrimido[5,4-b]indole-2,4-dione
Also Known As: (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione, 3-[(E)-(2-fluorophenyl)methylideneamino]-9-methoxy-1,5-dihydropyrimido[5,4-b]indole-2,4-dione, 3-{[(E)-(2-fluorophenyl)methylidene]amino}-2-hydroxy-9-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Technical Specifications
| Molecular Formula | C18H13FN4O3 |
| Molecular Weight | 352.09717 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 86.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.09717 Da |
| Heavy Atoms | 26 |
| Complexity | 601.0 |
| SMILES | COC1=CC=CC2=C1C3=C(N2)C(=O)N(C(=O)N3)/N=C/C4=CC=CC=C4F |
| InChIKey | LSVWDLWQGGCHNR-AWQFTUOYSA-N |
Chemical Property Profile of (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Property Insights of (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione. The TPSA of 86.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione. Following Lipinski's Rule of Five, (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione has 2 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 (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione?
The CAS number of (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione is 674351-11-2.
What is the molecular formula of (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione?
The molecular formula of (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione is C18H13FN4O3.
What is the molecular weight of (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione?
The molecular weight of (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione is 352.09717 g/mol.
Where can I buy (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione?
You can request a quote for (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione?
Yes, CoreyChem provides custom synthesis services for (E)-3-((2-fluorobenzylidene)amino)-9-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.