F6548-4640
TL;DR: F6548-4640 (CAS 896697-86-2) is a chemical compound with molecular formula C23H16FN3O3S and molecular weight 433.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(1,3-benzodioxol-5-ylamino)quinazolin-2-yl]sulfanyl-1-(4-fluorophenyl)ethanone
Also Known As: F6548-4640, 2-({4-[(2H-1,3-benzodioxol-5-yl)amino]quinazolin-2-yl}sulfanyl)-1-(4-fluorophenyl)ethan-1-one, 2-((4-(benzo[d][1,3]dioxol-5-ylamino)quinazolin-2-yl)thio)-1-(4-fluorophenyl)ethanone, 2-[4-(1,3-benzodioxol-5-ylamino)quinazolin-2-yl]sulfanyl-1-(4-fluorophenyl)ethanone, 2-[4-(benzo[1,3]dioxol-5-ylamino)quinazolin-2-yl]sulfanyl-1-(4-fluorophenyl)ethanone
| Molecular Formula | C23H16FN3O3S |
|---|---|
| Molecular Weight | 433.09 g/mol |
| LogP | 5.2162 |
| Topological Polar Surface Area | 73.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 433.08963 |
| Heavy Atoms | 31 |
| Complexity | 1281.0514 |
Chemical Identifiers
| CAS Number | 896697-86-2 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC3=NC(=NC4=CC=CC=C43)SCC(=O)C5=CC=C(C=C5)F |
Product Overview
F6548-4640 (CAS 896697-86-2), with molecular formula C23H16FN3O3S and molecular weight 433.09 g/mol. IUPAC: 2-[4-(1,3-benzodioxol-5-ylamino)quinazolin-2-yl]sulfanyl-1-(4-fluorophenyl)ethanone.
Chemical Property Profile of F6548-4640
Property Insights of F6548-4640
The XLogP value of 5.2162 indicates that F6548-4640 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.34 Ų falls within the moderate polarity range, balancing permeability and solubility for F6548-4640. Following Lipinski's Rule of Five, F6548-4640 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F6548-4640?
The CAS number of F6548-4640 is 896697-86-2.
What is the molecular formula of F6548-4640?
The molecular formula of F6548-4640 is C23H16FN3O3S.
What is the molecular weight of F6548-4640?
The molecular weight of F6548-4640 is 433.09 g/mol.
Where can I buy F6548-4640?
You can request a quote for F6548-4640 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F6548-4640?
Yes, KEHONG BIO provides custom synthesis services for F6548-4640 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.