F6548-4176
TL;DR: F6548-4176 (CAS 689770-66-9) is a chemical compound with molecular formula C28H28N4O3S and molecular weight 500.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-methylphenyl)methyl]-4-[(6-morpholin-4-yl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]benzamide
Also Known As: F6548-4176, N-[(4-methylphenyl)methyl]-4-{[6-(morpholin-4-yl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl]methyl}benzamide, N-(4-methylbenzyl)-4-((6-morpholino-4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)benzamide, N-[(4-methylphenyl)methyl]-4-[(6-morpholin-4-yl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]benzamide
| Molecular Formula | C28H28N4O3S |
|---|---|
| Molecular Weight | 500.19 g/mol |
| LogP | 4.18241 |
| Topological Polar Surface Area | 79.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 500.1882 |
| Heavy Atoms | 36 |
| Complexity | 1501.5986 |
Chemical Identifiers
| CAS Number | 689770-66-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)CN3C(=O)C4=C(C=CC(=C4)N5CCOCC5)NC3=S |
Product Overview
F6548-4176 (CAS 689770-66-9), with molecular formula C28H28N4O3S and molecular weight 500.19 g/mol. IUPAC: N-[(4-methylphenyl)methyl]-4-[(6-morpholin-4-yl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]benzamide.
Chemical Property Profile of F6548-4176
Property Insights of F6548-4176
The XLogP value of 4.18241 indicates that F6548-4176 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.36 Ų falls within the moderate polarity range, balancing permeability and solubility for F6548-4176. Following Lipinski's Rule of Five, F6548-4176 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F6548-4176?
The CAS number of F6548-4176 is 689770-66-9.
What is the molecular formula of F6548-4176?
The molecular formula of F6548-4176 is C28H28N4O3S.
What is the molecular weight of F6548-4176?
The molecular weight of F6548-4176 is 500.19 g/mol.
Where can I buy F6548-4176?
You can request a quote for F6548-4176 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F6548-4176?
Yes, KEHONG BIO provides custom synthesis services for F6548-4176 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.