ChemDiv1_009869
TL;DR: ChemDiv1_009869 (CAS 438244-24-7) is a chemical compound with molecular formula C23H26N4O4S2 and molecular weight 486.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(5Z)-5-[(9-methyl-4-oxo-2-pyrrolidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid
Also Known As: ChemDiv1_009869, 6-[(5Z)-5-{[9-methyl-4-oxo-2-(pyrrolidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid, (Z)-6-(5-((9-methyl-4-oxo-2-(pyrrolidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid, 6-[(5Z)-5-[(9-methyl-4-oxo-2-pyrrolidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid, 6-[(5Z)-5-{[9-METHYL-4-OXO-2-(PYRROLIDIN-1-YL)-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL]METHYLIDENE}-4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]HEXANOIC ACID
| Molecular Formula | C23H26N4O4S2 |
|---|---|
| Molecular Weight | 486.14 g/mol |
| LogP | 3.44932 |
| Topological Polar Surface Area | 95.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 486.13956 |
| Heavy Atoms | 33 |
| Complexity | 1200.8999 |
Chemical Identifiers
| CAS Number | 438244-24-7 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC(=C(C2=O)/C=C\3/C(=O)N(C(=S)S3)CCCCCC(=O)O)N4CCCC4 |
Product Overview
ChemDiv1_009869 (CAS 438244-24-7), with molecular formula C23H26N4O4S2 and molecular weight 486.14 g/mol. IUPAC: 6-[(5Z)-5-[(9-methyl-4-oxo-2-pyrrolidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid.
Chemical Property Profile of ChemDiv1_009869
Property Insights of ChemDiv1_009869
The XLogP value of 3.44932 indicates that ChemDiv1_009869 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.22 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_009869. Following Lipinski's Rule of Five, ChemDiv1_009869 has 1 hydrogen bond donor(s) and 7 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 ChemDiv1_009869?
The CAS number of ChemDiv1_009869 is 438244-24-7.
What is the molecular formula of ChemDiv1_009869?
The molecular formula of ChemDiv1_009869 is C23H26N4O4S2.
What is the molecular weight of ChemDiv1_009869?
The molecular weight of ChemDiv1_009869 is 486.14 g/mol.
Where can I buy ChemDiv1_009869?
You can request a quote for ChemDiv1_009869 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009869?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009869 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.