F6548-4166
TL;DR: F6548-4166 (CAS 689770-36-3) is a chemical compound with molecular formula C27H25ClN4O3S and molecular weight 520.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chlorophenyl)methyl]-4-[(6-morpholin-4-yl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]benzamide
Also Known As: F6548-4166, N-(3-chlorobenzyl)-4-((6-morpholino-4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)benzamide, N-[(3-chlorophenyl)methyl]-4-[(6-morpholin-4-yl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]benzamide, N-[(3-chlorophenyl)methyl]-4-{[6-(morpholin-4-yl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl]methyl}benzamide
| Molecular Formula | C27H25ClN4O3S |
|---|---|
| Molecular Weight | 520.13 g/mol |
| LogP | 4.52739 |
| Topological Polar Surface Area | 79.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 520.1336 |
| Heavy Atoms | 36 |
| Complexity | 1525.0726 |
Chemical Identifiers
| CAS Number | 689770-36-3 |
|---|---|
| SMILES | C1COCCN1C2=CC3=C(C=C2)NC(=S)N(C3=O)CC4=CC=C(C=C4)C(=O)NCC5=CC(=CC=C5)Cl |
Product Overview
F6548-4166 (CAS 689770-36-3), with molecular formula C27H25ClN4O3S and molecular weight 520.13 g/mol. IUPAC: N-[(3-chlorophenyl)methyl]-4-[(6-morpholin-4-yl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]benzamide.
Chemical Property Profile of F6548-4166
Property Insights of F6548-4166
The XLogP value of 4.52739 indicates that F6548-4166 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 F6548-4166. Following Lipinski's Rule of Five, F6548-4166 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 F6548-4166?
The CAS number of F6548-4166 is 689770-36-3.
What is the molecular formula of F6548-4166?
The molecular formula of F6548-4166 is C27H25ClN4O3S.
What is the molecular weight of F6548-4166?
The molecular weight of F6548-4166 is 520.13 g/mol.
Where can I buy F6548-4166?
You can request a quote for F6548-4166 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F6548-4166?
Yes, KEHONG BIO provides custom synthesis services for F6548-4166 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.