E-3846
TL;DR: E-3846 (CAS 106894-54-6) is a chemical compound with molecular formula C17H13FN2O3 and molecular weight 312.09103 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-cyclopropyl-6-fluoro-4-oxo-7-pyrrol-1-ylquinoline-3-carboxylic acid
Also Known As: E-3846, E 3846, 6-Fluoro-1-cyclopropyl-1,4-dihydro-4-oxo-7-(pyrrol-1-yl)quinoline-3-carboxylic acid, 1-cyclopropyl-6-fluoro-4-oxo-7-pyrrol-1-ylquinoline-3-carboxylic acid, 1-Cyclopropyl-6-fluoro-4-oxo-7-(1H-pyrrol-1-yl)-1,4-dihydroquinoline-3-carboxylic acid
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H13FN2O3 |
| Molecular Weight | 312.09103 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 62.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.09103 Da |
| Heavy Atoms | 23 |
| Complexity | 554.0 |
| SMILES | C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4C=CC=C4)F)C(=O)O |
| InChIKey | ISJRMOARTUIEPA-UHFFFAOYSA-N |
Chemical Property Profile of E-3846
Property Insights of E-3846
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for E-3846. The TPSA of 62.5 Ų falls within the moderate polarity range, balancing permeability and solubility for E-3846. Following Lipinski's Rule of Five, E-3846 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 E-3846?
The CAS number of E-3846 is 106894-54-6.
What is the molecular formula of E-3846?
The molecular formula of E-3846 is C17H13FN2O3.
What is the molecular weight of E-3846?
The molecular weight of E-3846 is 312.09103 g/mol.
Where can I buy E-3846?
You can request a quote for E-3846 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for E-3846?
Yes, CoreyChem provides custom synthesis services for E-3846 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.