BRD-A82117562-001-01-8
TL;DR: BRD-A82117562-001-01-8 (CAS 959564-98-8) is a chemical compound with molecular formula C27H23FN4O2S and molecular weight 486.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-[(4-fluorophenyl)methylsulfanyl]-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]-N-(2-phenylethyl)acetamide
Also Known As: BRD-A82117562-001-01-8, K279-1537, F6548-4086, 2-(5-((4-fluorobenzyl)thio)-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-2-yl)-N-phenethylacetamide, 2-(5-{[(4-fluorophenyl)methyl]sulfanyl}-3-oxo-2H,3H-imidazo[1,2-c]quinazolin-2-yl)-N-(2-phenylethyl)acetamide
| Molecular Formula | C27H23FN4O2S |
|---|---|
| Molecular Weight | 486.15 g/mol |
| LogP | 4.4666 |
| Topological Polar Surface Area | 74.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 486.1526 |
| Heavy Atoms | 35 |
| Complexity | 1308.2712 |
Chemical Identifiers
| CAS Number | 959564-98-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNC(=O)CC2C(=O)N3C(=N2)C4=CC=CC=C4N=C3SCC5=CC=C(C=C5)F |
Product Overview
BRD-A82117562-001-01-8 (CAS 959564-98-8), with molecular formula C27H23FN4O2S and molecular weight 486.15 g/mol. IUPAC: 2-[5-[(4-fluorophenyl)methylsulfanyl]-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]-N-(2-phenylethyl)acetamide.
Chemical Property Profile of BRD-A82117562-001-01-8
Property Insights of BRD-A82117562-001-01-8
The XLogP value of 4.4666 indicates that BRD-A82117562-001-01-8 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.13 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-A82117562-001-01-8. Following Lipinski's Rule of Five, BRD-A82117562-001-01-8 has 1 hydrogen bond donor(s) and 5 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 BRD-A82117562-001-01-8?
The CAS number of BRD-A82117562-001-01-8 is 959564-98-8.
What is the molecular formula of BRD-A82117562-001-01-8?
The molecular formula of BRD-A82117562-001-01-8 is C27H23FN4O2S.
What is the molecular weight of BRD-A82117562-001-01-8?
The molecular weight of BRD-A82117562-001-01-8 is 486.15 g/mol.
Where can I buy BRD-A82117562-001-01-8?
You can request a quote for BRD-A82117562-001-01-8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-A82117562-001-01-8?
Yes, KEHONG BIO provides custom synthesis services for BRD-A82117562-001-01-8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.