5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one
TL;DR: 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one (CAS 865654-73-5) is a chemical compound with molecular formula C16H13FN2O and molecular weight 268.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one
Also Known As: IFLab1_006393, F1596-1175, 5-(4-fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one, 5-(4-fluorophenyl)-7-methyl-1H-benzo[e][1,4]diazepin-2(3H)-one, 5-(4-fluorophenyl)-7-methyl-2,3-dihydro-1H-1,4-benzodiazepin-2-one
| Molecular Formula | C16H13FN2O |
|---|---|
| Molecular Weight | 268.10 g/mol |
| LogP | 2.92362 |
| Topological Polar Surface Area | 41.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 268.1012 |
| Heavy Atoms | 20 |
| Complexity | 704.9169 |
Chemical Identifiers
| CAS Number | 865654-73-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(=O)CN=C2C3=CC=C(C=C3)F |
Product Overview
5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one (CAS 865654-73-5), with molecular formula C16H13FN2O and molecular weight 268.10 g/mol. IUPAC: 5-(4-fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one.
Chemical Property Profile of 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one
Property Insights of 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one
The XLogP value of 2.92362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one. With a topological polar surface area (TPSA) of 41.46 Ų, 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one has 1 hydrogen bond donor(s) and 2 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 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one?
The CAS number of 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one is 865654-73-5.
What is the molecular formula of 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one?
The molecular formula of 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one is C16H13FN2O.
What is the molecular weight of 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one?
The molecular weight of 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one is 268.10 g/mol.
Where can I buy 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one?
You can request a quote for 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Fluorophenyl)-7-methyl-1,3-dihydro-1,4-benzodiazepin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.