F0916-6361
TL;DR: F0916-6361 (CAS 451466-96-9) is a chemical compound with molecular formula C26H21N3O4S and molecular weight 471.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzodioxol-5-ylmethyl)-7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-sulfanylidene-1H-quinazolin-4-one
Also Known As: F0916-6361, 3-(1,3-benzodioxol-5-ylmethyl)-7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-sulfanylidene-1H-quinazolin-4-one, 3-(benzo[d][1,3]dioxol-5-ylmethyl)-7-(1,2,3,4-tetrahydroisoquinoline-2-carbonyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one, 3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-sulfanylidene-7-(1,2,3,4-tetrahydroisoquinoline-2-carbonyl)-1,2,3,4-tetrahydroquinazolin-4-one
| Molecular Formula | C26H21N3O4S |
|---|---|
| Molecular Weight | 471.13 g/mol |
| LogP | 4.03459 |
| Topological Polar Surface Area | 76.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 471.12527 |
| Heavy Atoms | 34 |
| Complexity | 1572.853 |
Chemical Identifiers
| CAS Number | 451466-96-9 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CC5=CC6=C(C=C5)OCO6 |
Product Overview
F0916-6361 (CAS 451466-96-9), with molecular formula C26H21N3O4S and molecular weight 471.13 g/mol. IUPAC: 3-(1,3-benzodioxol-5-ylmethyl)-7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-sulfanylidene-1H-quinazolin-4-one.
Chemical Property Profile of F0916-6361
Property Insights of F0916-6361
The XLogP value of 4.03459 indicates that F0916-6361 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.56 Ų falls within the moderate polarity range, balancing permeability and solubility for F0916-6361. Following Lipinski's Rule of Five, F0916-6361 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0916-6361?
The CAS number of F0916-6361 is 451466-96-9.
What is the molecular formula of F0916-6361?
The molecular formula of F0916-6361 is C26H21N3O4S.
What is the molecular weight of F0916-6361?
The molecular weight of F0916-6361 is 471.13 g/mol.
Where can I buy F0916-6361?
You can request a quote for F0916-6361 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0916-6361?
Yes, KEHONG BIO provides custom synthesis services for F0916-6361 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.