6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine
TL;DR: 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine (CAS 1023590-16-0) is a chemical compound with molecular formula C13H15FN2O and molecular weight 234.11684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine
Also Known As: 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine, 6-(4-fluorophenoxy) -2,3-dihydro-5,7-dimethyl-1H-1,4-diazepine
Technical Specifications
| Molecular Formula | C13H15FN2O |
| Molecular Weight | 234.11684 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 33.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.11684 Da |
| Heavy Atoms | 17 |
| Complexity | 330.0 |
| SMILES | CC1=C(C(=NCCN1)C)OC2=CC=C(C=C2)F |
| InChIKey | XARJCDFWHIDUHH-UHFFFAOYSA-N |
Chemical Property Profile of 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine
Property Insights of 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine. With a topological polar surface area (TPSA) of 33.6 Ų, 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine?
The CAS number of 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine is 1023590-16-0.
What is the molecular formula of 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine?
The molecular formula of 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine is C13H15FN2O.
What is the molecular weight of 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine?
The molecular weight of 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine is 234.11684 g/mol.
Where can I buy 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine?
You can request a quote for 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine?
Yes, CoreyChem provides custom synthesis services for 6-(4-fluorophenoxy)-5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.