RefChem:460924
TL;DR: RefChem:460924 (CAS 442552-58-1) is a chemical compound with molecular formula C18H20N4O2S2 and molecular weight 388.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[2-(ethylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (Z)-5-((2-(ethylamino)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-3-isobutyl-2-thioxothiazolidin-4-one, F1260-1770, (5Z)-5-{[2-(ethylamino)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one, (5Z)-5-[[2-(ethylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one, 2-(ethylamino)-3-[(Z)-(3-isobutyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
| Molecular Formula | C18H20N4O2S2 |
|---|---|
| Molecular Weight | 388.10 g/mol |
| LogP | 2.9835 |
| Topological Polar Surface Area | 66.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.10278 |
| Heavy Atoms | 26 |
| Complexity | 965.3077 |
Chemical Identifiers
| CAS Number | 442552-58-1 |
|---|---|
| SMILES | CCNC1=C(C(=O)N2C=CC=CC2=N1)/C=C\3/C(=O)N(C(=S)S3)CC(C)C |
Product Overview
RefChem:460924 (CAS 442552-58-1), with molecular formula C18H20N4O2S2 and molecular weight 388.10 g/mol. IUPAC: (5Z)-5-[[2-(ethylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:460924
Property Insights of RefChem:460924
The XLogP value of 2.9835 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:460924. The TPSA of 66.71 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:460924. Following Lipinski's Rule of Five, RefChem:460924 has 1 hydrogen bond donor(s) and 6 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 RefChem:460924?
The CAS number of RefChem:460924 is 442552-58-1.
What is the molecular formula of RefChem:460924?
The molecular formula of RefChem:460924 is C18H20N4O2S2.
What is the molecular weight of RefChem:460924?
The molecular weight of RefChem:460924 is 388.10 g/mol.
Where can I buy RefChem:460924?
You can request a quote for RefChem:460924 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:460924?
Yes, KEHONG BIO provides custom synthesis services for RefChem:460924 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.