1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F
TL;DR: 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F (CAS 1959-97-3) is a chemical compound with molecular formula C16H12ClFN2O and molecular weight 302.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-7-fluoro-1-methyl-3H-1,4-benzodiazepin-2-one
Also Known As: J1.605.600F, 1,4-BENZODIAZPN2-ON,1-ME5(4-CLPH)7F, 1-Methyl-5-(4-chlorophenyl)-7-fluoro-1,3-dihydro-2H-1,4-benzodiazepine-2-one, 5-(4-Chlorophenyl)-7-fluoro-1-methyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one, 5-(4-chlorophenyl)-7-fluoro-1-methyl-2,3-dihydro-1H-1,4-benzodiazepin-2-one
| Molecular Formula | C16H12ClFN2O |
|---|---|
| Molecular Weight | 302.06 g/mol |
| LogP | 3.2929 |
| Topological Polar Surface Area | 32.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 302.06223 |
| Heavy Atoms | 21 |
| Complexity | 740.44226 |
Chemical Identifiers
| CAS Number | 1959-97-3 |
|---|---|
| SMILES | CN1C(=O)CN=C(C2=C1C=CC(=C2)F)C3=CC=C(C=C3)Cl |
Product Overview
1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F (CAS 1959-97-3), with molecular formula C16H12ClFN2O and molecular weight 302.06 g/mol. IUPAC: 5-(4-chlorophenyl)-7-fluoro-1-methyl-3H-1,4-benzodiazepin-2-one.
Chemical Property Profile of 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F
Property Insights of 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F
The XLogP value of 3.2929 indicates that 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.67 Ų, 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F has 0 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 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F?
The CAS number of 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F is 1959-97-3.
What is the molecular formula of 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F?
The molecular formula of 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F is C16H12ClFN2O.
What is the molecular weight of 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F?
The molecular weight of 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F is 302.06 g/mol.
Where can I buy 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F?
You can request a quote for 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Benzodiazpn2-ON,1-ME5(4-clph)7F and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.