BAS 03539574
TL;DR: BAS 03539574 (CAS 5955-78-2) is a chemical compound with molecular formula C13H16N2O3S and molecular weight 280.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-methyl-4-(3-methylthiophen-2-yl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 03539574, BIM-0038338.P001, ethyl 4-methyl-6-(3-methyl(2-thienyl))-2-oxo-1,3,6-trihydropyrimidine-5-carbox ylate, ethyl 6-methyl-4-(3-methylthiophen-2-yl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, 5-Pyrimidinecarboxylicacid,1,2,3,4-tetrahydro-6-methyl-4-(3-methyl-2-thienyl)-2-oxo-,ethylester(9CI)
| Molecular Formula | C13H16N2O3S |
|---|---|
| Molecular Weight | 280.09 g/mol |
| LogP | 2.24752 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.08817 |
| Heavy Atoms | 19 |
| Complexity | 547.83813 |
Chemical Identifiers
| CAS Number | 5955-78-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=O)NC1C2=C(C=CS2)C)C |
Product Overview
BAS 03539574 (CAS 5955-78-2), with molecular formula C13H16N2O3S and molecular weight 280.09 g/mol. IUPAC: ethyl 6-methyl-4-(3-methylthiophen-2-yl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 03539574
Property Insights of BAS 03539574
The XLogP value of 2.24752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03539574. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03539574. Following Lipinski's Rule of Five, BAS 03539574 has 2 hydrogen bond donor(s) and 4 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 BAS 03539574?
The CAS number of BAS 03539574 is 5955-78-2.
What is the molecular formula of BAS 03539574?
The molecular formula of BAS 03539574 is C13H16N2O3S.
What is the molecular weight of BAS 03539574?
The molecular weight of BAS 03539574 is 280.09 g/mol.
Where can I buy BAS 03539574?
You can request a quote for BAS 03539574 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03539574?
Yes, KEHONG BIO provides custom synthesis services for BAS 03539574 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.