A1927/0081045
TL;DR: A1927/0081045 (CAS 312506-87-9) is a chemical compound with molecular formula C22H20N2O4S2 and molecular weight 440.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2E)-2-[(3-methoxyphenyl)methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: A1927/0081045, ethyl 2-(3-methoxybenzylidene)-7-methyl-3-oxo-5-(2-thienyl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl (2E)-2-[(3-methoxyphenyl)methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ETHYL (2E)-2-(3-METHOXYBENZYLIDENE)-7-METHYL-3-OXO-5-(2-THIENYL)-2,3-DIHYDRO-5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE, ETHYL (2E)-2-[(3-METHOXYPHENYL)METHYLIDENE]-7-METHYL-3-OXO-5-(THIOPHEN-2-YL)-2H,3H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE
| Molecular Formula | C22H20N2O4S2 |
|---|---|
| Molecular Weight | 440.09 g/mol |
| LogP | 2.8684 |
| Topological Polar Surface Area | 69.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 440.08646 |
| Heavy Atoms | 30 |
| Complexity | 1299.598 |
Chemical Identifiers
| CAS Number | 312506-87-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)/C(=C\C4=CC(=CC=C4)OC)/S2)C |
Product Overview
A1927/0081045 (CAS 312506-87-9), with molecular formula C22H20N2O4S2 and molecular weight 440.09 g/mol. IUPAC: ethyl (2E)-2-[(3-methoxyphenyl)methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of A1927/0081045
Property Insights of A1927/0081045
The XLogP value of 2.8684 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A1927/0081045. The TPSA of 69.89 Ų falls within the moderate polarity range, balancing permeability and solubility for A1927/0081045. Following Lipinski's Rule of Five, A1927/0081045 has 0 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 A1927/0081045?
The CAS number of A1927/0081045 is 312506-87-9.
What is the molecular formula of A1927/0081045?
The molecular formula of A1927/0081045 is C22H20N2O4S2.
What is the molecular weight of A1927/0081045?
The molecular weight of A1927/0081045 is 440.09 g/mol.
Where can I buy A1927/0081045?
You can request a quote for A1927/0081045 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1927/0081045?
Yes, KEHONG BIO provides custom synthesis services for A1927/0081045 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.