CBKinase1_004216
TL;DR: CBKinase1_004216 (CAS 477332-90-4) is a chemical compound with molecular formula C29H23N3O2S and molecular weight 477.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-phenylphenyl)acetamide
Also Known As: CBKinase1_004216, CBKinase1_016616, N-[1,1'-BIPHENYL]-2-YL-2-{[3-(4-METHYLPHENYL)-4-OXO-3,4-DIHYDRO-2-QUINAZOLINYL]SULFANYL}ACETAMIDE, BRD-K32720181-001-01-9, N-([1,1'-Biphenyl]-2-yl)-2-((4-oxo-3-(p-tolyl)-3,4-dihydroquinazolin-2-yl)thio)acetamide
| Molecular Formula | C29H23N3O2S |
|---|---|
| Molecular Weight | 477.15 g/mol |
| LogP | 6.09192 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 477.1511 |
| Heavy Atoms | 35 |
| Complexity | 1561.3151 |
Chemical Identifiers
| CAS Number | 477332-90-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4C5=CC=CC=C5 |
Product Overview
CBKinase1_004216 (CAS 477332-90-4), with molecular formula C29H23N3O2S and molecular weight 477.15 g/mol. IUPAC: 2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-phenylphenyl)acetamide.
Chemical Property Profile of CBKinase1_004216
Property Insights of CBKinase1_004216
The XLogP value of 6.09192 indicates that CBKinase1_004216 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004216. Following Lipinski's Rule of Five, CBKinase1_004216 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_004216?
The CAS number of CBKinase1_004216 is 477332-90-4.
What is the molecular formula of CBKinase1_004216?
The molecular formula of CBKinase1_004216 is C29H23N3O2S.
What is the molecular weight of CBKinase1_004216?
The molecular weight of CBKinase1_004216 is 477.15 g/mol.
Where can I buy CBKinase1_004216?
You can request a quote for CBKinase1_004216 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004216?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004216 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.