RefChem:1057889
TL;DR: RefChem:1057889 (CAS 61197-44-2) is a chemical compound with molecular formula C20H17ClN4O and molecular weight 364.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-8-chloro-2-(dimethylaminomethylidene)-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-one
Also Known As: 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-2-((dimethylamino)methylene)-6-phenyl-, (2E)-8-chloro-2-(dimethylaminomethylidene)-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-one, 8-chloro-2-(dimethylamino-methylene)-6-phenyl-2,4-dihydro-benzo[6,7]imidazo[1,2-a][1,4]diazepin-1-one, RefChem:1057889
| Molecular Formula | C20H17ClN4O |
|---|---|
| Molecular Weight | 364.11 g/mol |
| LogP | 3.3391 |
| Topological Polar Surface Area | 48.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 364.1091 |
| Heavy Atoms | 26 |
| Complexity | 976.5606 |
Chemical Identifiers
| CAS Number | 61197-44-2 |
|---|---|
| SMILES | CN(C)/C=C/1\C(=O)N2C(=N1)CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4 |
Product Overview
RefChem:1057889 (CAS 61197-44-2), with molecular formula C20H17ClN4O and molecular weight 364.11 g/mol. IUPAC: (2E)-8-chloro-2-(dimethylaminomethylidene)-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-one.
Chemical Property Profile of RefChem:1057889
Property Insights of RefChem:1057889
The XLogP value of 3.3391 indicates that RefChem:1057889 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.27 Ų, RefChem:1057889 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1057889 has 0 hydrogen bond donor(s) and 4 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 RefChem:1057889?
The CAS number of RefChem:1057889 is 61197-44-2.
What is the molecular formula of RefChem:1057889?
The molecular formula of RefChem:1057889 is C20H17ClN4O.
What is the molecular weight of RefChem:1057889?
The molecular weight of RefChem:1057889 is 364.11 g/mol.
Where can I buy RefChem:1057889?
You can request a quote for RefChem:1057889 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1057889?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1057889 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.