RefChem:283797
TL;DR: RefChem:283797 (CAS 61555-05-3) is a chemical compound with molecular formula C18H17BrN4OS and molecular weight 416.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4,5-dihydro-1H-imidazol-2-ylmethylsulfanyl)-3-phenylquinazolin-4-one;hydrobromide
Also Known As: 4(3H)-Quinazolinone, 2-((2-imidazolin-2-ylmethyl)thio)-3-phenyl-, monohydrobromide, 2-((2-Imidazolin-2-ylmethyl)thio)-3-phenyl-4(3H)-quinazolinone monohydrobromide, 2-(4,5-Dihydro-1H-imidazol-2-ylmethylsulfanyl)-3-phenylquinazolin-4-onehydrobromide, 2-(4,5-dihydro-1H-imidazol-2-ylmethylsulfanyl)-3-phenylquinazolin-4-one hydrobromide, 2-{[(4,5-Dihydro-1H-imidazol-2-yl)methyl]sulfanyl}-3-phenylquinazolin-4(3H)-one--hydrogen bromide (1/1)
| Molecular Formula | C18H17BrN4OS |
|---|---|
| Molecular Weight | 416.03 g/mol |
| LogP | 3.06 |
| Topological Polar Surface Area | 82.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 416.03064 |
| Heavy Atoms | 25 |
| Complexity | 541.0 |
Chemical Identifiers
| CAS Number | 61555-05-3 |
|---|---|
| SMILES | C1CN=C(N1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4.Br |
| InChIKey | MHZYQBFNJSEKRY-UHFFFAOYSA-N |
Product Overview
RefChem:283797 (CAS 61555-05-3), with molecular formula C18H17BrN4OS and molecular weight 416.03 g/mol. IUPAC: 2-(4,5-dihydro-1H-imidazol-2-ylmethylsulfanyl)-3-phenylquinazolin-4-one;hydrobromide.
Chemical Property Profile of RefChem:283797
Property Insights of RefChem:283797
The XLogP value of 3.06 indicates that RefChem:283797 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:283797. Following Lipinski's Rule of Five, RefChem:283797 has 2 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:283797?
The CAS number of RefChem:283797 is 61555-05-3.
What is the molecular formula of RefChem:283797?
The molecular formula of RefChem:283797 is C18H17BrN4OS.
What is the molecular weight of RefChem:283797?
The molecular weight of RefChem:283797 is 416.03 g/mol.
Where can I buy RefChem:283797?
You can request a quote for RefChem:283797 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:283797?
Yes, KEHONG BIO provides custom synthesis services for RefChem:283797 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.