RefChem:1057900
TL;DR: RefChem:1057900 (CAS 63146-63-4) is a chemical compound with molecular formula C24H16ClN3O and molecular weight 397.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-benzylidene-8-chloro-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-6-phenyl-2-(phenylmethylene)-, 2,4-Dihydro-8-chloro-6-phenyl-2-(phenylmethylene)-1H-imidazo(1,2-a)(1,4)benzodiazepin-1-one, (2E)-2-benzylidene-8-chloro-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-one, RefChem:1057900, BRN 0578099
| Molecular Formula | C24H16ClN3O |
|---|---|
| Molecular Weight | 397.10 g/mol |
| LogP | 4.9772 |
| Topological Polar Surface Area | 45.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 397.09818 |
| Heavy Atoms | 29 |
| Complexity | 1197.3102 |
Chemical Identifiers
| CAS Number | 63146-63-4 |
|---|---|
| SMILES | C1C2=N/C(=C/C3=CC=CC=C3)/C(=O)N2C4=C(C=C(C=C4)Cl)C(=N1)C5=CC=CC=C5 |
Product Overview
RefChem:1057900 (CAS 63146-63-4), with molecular formula C24H16ClN3O and molecular weight 397.10 g/mol. IUPAC: (2E)-2-benzylidene-8-chloro-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-one.
Chemical Property Profile of RefChem:1057900
Property Insights of RefChem:1057900
The XLogP value of 4.9772 indicates that RefChem:1057900 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.03 Ų, RefChem:1057900 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1057900 has 0 hydrogen bond donor(s) and 3 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:1057900?
The CAS number of RefChem:1057900 is 63146-63-4.
What is the molecular formula of RefChem:1057900?
The molecular formula of RefChem:1057900 is C24H16ClN3O.
What is the molecular weight of RefChem:1057900?
The molecular weight of RefChem:1057900 is 397.10 g/mol.
Where can I buy RefChem:1057900?
You can request a quote for RefChem:1057900 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1057900?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1057900 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.