A2910/0122637
TL;DR: A2910/0122637 (CAS 428487-77-8) is a chemical compound with molecular formula C20H12F4N4O2S and molecular weight 448.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6Z)-6-[[4-[(2-fluorophenyl)methoxy]phenyl]methylidene]-5-imino-2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: A2910/0122637, (6Z)-6-[[4-[(2-fluorophenyl)methoxy]phenyl]methylidene]-5-imino-2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, (6Z)-6-{4-[(2-fluorobenzyl)oxy]benzylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
| Molecular Formula | C20H12F4N4O2S |
|---|---|
| Molecular Weight | 448.06 g/mol |
| LogP | 4.58617 |
| Topological Polar Surface Area | 78.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 448.0617 |
| Heavy Atoms | 31 |
| Complexity | 1156.515 |
Chemical Identifiers
| CAS Number | 428487-77-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)COC2=CC=C(C=C2)/C=C\3/C(=N)N4C(=NC3=O)SC(=N4)C(F)(F)F)F |
Product Overview
A2910/0122637 (CAS 428487-77-8), with molecular formula C20H12F4N4O2S and molecular weight 448.06 g/mol. IUPAC: (6Z)-6-[[4-[(2-fluorophenyl)methoxy]phenyl]methylidene]-5-imino-2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.
Chemical Property Profile of A2910/0122637
Property Insights of A2910/0122637
The XLogP value of 4.58617 indicates that A2910/0122637 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.11 Ų falls within the moderate polarity range, balancing permeability and solubility for A2910/0122637. Following Lipinski's Rule of Five, A2910/0122637 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 A2910/0122637?
The CAS number of A2910/0122637 is 428487-77-8.
What is the molecular formula of A2910/0122637?
The molecular formula of A2910/0122637 is C20H12F4N4O2S.
What is the molecular weight of A2910/0122637?
The molecular weight of A2910/0122637 is 448.06 g/mol.
Where can I buy A2910/0122637?
You can request a quote for A2910/0122637 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2910/0122637?
Yes, KEHONG BIO provides custom synthesis services for A2910/0122637 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.