BAS 02395004
TL;DR: BAS 02395004 (CAS 5984-08-7) is a chemical compound with molecular formula C12H14N2O3S2 and molecular weight 298.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Also Known As: BAS 02395004, BIM-0039795.P001, J1.211.837F, ethyl 2-((5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio)acetate, ethyl [(5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)thio]acetate
| Molecular Formula | C12H14N2O3S2 |
|---|---|
| Molecular Weight | 298.04 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.0446 |
| Heavy Atoms | 19 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 5984-08-7 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=C(C(=C(S2)C)C)C(=O)N1 |
| InChIKey | KPLIILSPLZUFTC-UHFFFAOYSA-N |
Product Overview
BAS 02395004 (CAS 5984-08-7), with molecular formula C12H14N2O3S2 and molecular weight 298.04 g/mol. IUPAC: ethyl 2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate.
Chemical Property Profile of BAS 02395004
Property Insights of BAS 02395004
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02395004. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02395004. Following Lipinski's Rule of Five, BAS 02395004 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 BAS 02395004?
The CAS number of BAS 02395004 is 5984-08-7.
What is the molecular formula of BAS 02395004?
The molecular formula of BAS 02395004 is C12H14N2O3S2.
What is the molecular weight of BAS 02395004?
The molecular weight of BAS 02395004 is 298.04 g/mol.
Where can I buy BAS 02395004?
You can request a quote for BAS 02395004 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02395004?
Yes, KEHONG BIO provides custom synthesis services for BAS 02395004 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.