RefChem:267892
TL;DR: RefChem:267892 (CAS 1755-83-5) is a chemical compound with molecular formula C22H27Cl4FN4O and molecular weight 522.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-5-(2-fluorophenyl)-1-[2-(4-methylpiperazin-1-yl)ethyl]-3H-1,4-benzodiazepin-2-one;trihydrochloride
Also Known As: 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-5-(o-fluorophenyl)-1-(2-(4-methyl-1-piperazinyl)ethyl)-, trihydrochloride, 7-chloro-5-(2-fluorophenyl)-1-[2-(4-methylpiperazin-1-yl)ethyl]-3H-1,4-benzodiazepin-2-one trihydrochloride, 2H-1,4-BENZODIAZEPIN-2-ONE, 1,3-DIHYDRO-7-CHLORO-5-(o-FLUOROPHENYL)-1-(2-(4-METH, 7-Chloro-5-(2-fluorophenyl)-1-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dihydro-2H-1,4-benzodiazepin-2-one--hydrogen chloride (1/3), RefChem:267892
| Molecular Formula | C22H27Cl4FN4O |
|---|---|
| Molecular Weight | 522.09 g/mol |
| LogP | 4.18 |
| Topological Polar Surface Area | 39.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 524.08936 |
| Heavy Atoms | 32 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 1755-83-5 |
|---|---|
| SMILES | CN1CCN(CC1)CCN2C(=O)CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4F.Cl.Cl.Cl |
| InChIKey | MVNSMCNZEKGRQF-UHFFFAOYSA-N |
Product Overview
RefChem:267892 (CAS 1755-83-5), with molecular formula C22H27Cl4FN4O and molecular weight 522.09 g/mol. IUPAC: 7-chloro-5-(2-fluorophenyl)-1-[2-(4-methylpiperazin-1-yl)ethyl]-3H-1,4-benzodiazepin-2-one;trihydrochloride.
Chemical Property Profile of RefChem:267892
Property Insights of RefChem:267892
The XLogP value of 4.18 indicates that RefChem:267892 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.2 Ų, RefChem:267892 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:267892 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:267892?
The CAS number of RefChem:267892 is 1755-83-5.
What is the molecular formula of RefChem:267892?
The molecular formula of RefChem:267892 is C22H27Cl4FN4O.
What is the molecular weight of RefChem:267892?
The molecular weight of RefChem:267892 is 522.09 g/mol.
Where can I buy RefChem:267892?
You can request a quote for RefChem:267892 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:267892?
Yes, KEHONG BIO provides custom synthesis services for RefChem:267892 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.