F0921-6545
TL;DR: F0921-6545 (CAS 850781-75-8) is a chemical compound with molecular formula C23H22N4O4S and molecular weight 450.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-(1,3-benzodioxol-5-ylmethylamino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one
Also Known As: F0921-6545, 3-(5-((benzo[d][1,3]dioxol-5-ylmethyl)amino)-1,3,4-thiadiazol-2-yl)-7-(diethylamino)-2H-chromen-2-one, 3-[5-(1,3-benzodioxol-5-ylmethylamino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one, 3-(5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1,3,4-thiadiazol-2-yl)-7-(diethylamino)-2H-chromen-2-one, 2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-5-[7-(diethylamino)-3-coumarinyl]-1,3,4-thiadiazole
| Molecular Formula | C23H22N4O4S |
|---|---|
| Molecular Weight | 450.14 g/mol |
| LogP | 4.4985 |
| Topological Polar Surface Area | 89.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 450.13617 |
| Heavy Atoms | 32 |
| Complexity | 1329.3232 |
Chemical Identifiers
| CAS Number | 850781-75-8 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NN=C(S3)NCC4=CC5=C(C=C4)OCO5 |
Product Overview
F0921-6545 (CAS 850781-75-8), with molecular formula C23H22N4O4S and molecular weight 450.14 g/mol. IUPAC: 3-[5-(1,3-benzodioxol-5-ylmethylamino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one.
Chemical Property Profile of F0921-6545
Property Insights of F0921-6545
The XLogP value of 4.4985 indicates that F0921-6545 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.72 Ų falls within the moderate polarity range, balancing permeability and solubility for F0921-6545. Following Lipinski's Rule of Five, F0921-6545 has 1 hydrogen bond donor(s) and 9 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 F0921-6545?
The CAS number of F0921-6545 is 850781-75-8.
What is the molecular formula of F0921-6545?
The molecular formula of F0921-6545 is C23H22N4O4S.
What is the molecular weight of F0921-6545?
The molecular weight of F0921-6545 is 450.14 g/mol.
Where can I buy F0921-6545?
You can request a quote for F0921-6545 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0921-6545?
Yes, KEHONG BIO provides custom synthesis services for F0921-6545 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.