F6548-4181
TL;DR: F6548-4181 (CAS 689770-81-8) is a chemical compound with molecular formula C30H29N5O3S and molecular weight 539.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1H-indol-3-yl)ethyl]-4-[(6-morpholin-4-yl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]benzamide
Also Known As: F6548-4181, N-[2-(1H-indol-3-yl)ethyl]-4-{[6-(morpholin-4-yl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl]methyl}benzamide, N-(2-(1H-indol-3-yl)ethyl)-4-((6-morpholino-4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)benzamide, N-[2-(1H-indol-3-yl)ethyl]-4-[(6-morpholin-4-yl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]benzamide
| Molecular Formula | C30H29N5O3S |
|---|---|
| Molecular Weight | 539.20 g/mol |
| LogP | 4.39779 |
| Topological Polar Surface Area | 95.15 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 539.1991 |
| Heavy Atoms | 39 |
| Complexity | 1764.0912 |
Chemical Identifiers
| CAS Number | 689770-81-8 |
|---|---|
| SMILES | C1COCCN1C2=CC3=C(C=C2)NC(=S)N(C3=O)CC4=CC=C(C=C4)C(=O)NCCC5=CNC6=CC=CC=C65 |
Product Overview
F6548-4181 (CAS 689770-81-8), with molecular formula C30H29N5O3S and molecular weight 539.20 g/mol. IUPAC: N-[2-(1H-indol-3-yl)ethyl]-4-[(6-morpholin-4-yl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]benzamide.
Chemical Property Profile of F6548-4181
Property Insights of F6548-4181
The XLogP value of 4.39779 indicates that F6548-4181 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.15 Ų falls within the moderate polarity range, balancing permeability and solubility for F6548-4181. Following Lipinski's Rule of Five, F6548-4181 has 3 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 F6548-4181?
The CAS number of F6548-4181 is 689770-81-8.
What is the molecular formula of F6548-4181?
The molecular formula of F6548-4181 is C30H29N5O3S.
What is the molecular weight of F6548-4181?
The molecular weight of F6548-4181 is 539.20 g/mol.
Where can I buy F6548-4181?
You can request a quote for F6548-4181 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F6548-4181?
Yes, KEHONG BIO provides custom synthesis services for F6548-4181 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.