BAS 01579821
TL;DR: BAS 01579821 (CAS 332392-83-3) is a chemical compound with molecular formula C21H22N2O4S2 and molecular weight 430.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[3-(4-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetate
Also Known As: BAS 01579821, ethyl {[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate, F1008-0056, ethyl 2-((3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate, ethyl 2-[[3-(4-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetate
| Molecular Formula | C21H22N2O4S2 |
|---|---|
| Molecular Weight | 430.10 g/mol |
| LogP | 3.9898 |
| Topological Polar Surface Area | 70.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 430.1021 |
| Heavy Atoms | 29 |
| Complexity | 1102.552 |
Chemical Identifiers
| CAS Number | 332392-83-3 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=C(C=C4)OC |
Product Overview
BAS 01579821 (CAS 332392-83-3), with molecular formula C21H22N2O4S2 and molecular weight 430.10 g/mol. IUPAC: ethyl 2-[[3-(4-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetate.
Chemical Property Profile of BAS 01579821
Property Insights of BAS 01579821
The XLogP value of 3.9898 indicates that BAS 01579821 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.42 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01579821. Following Lipinski's Rule of Five, BAS 01579821 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 BAS 01579821?
The CAS number of BAS 01579821 is 332392-83-3.
What is the molecular formula of BAS 01579821?
The molecular formula of BAS 01579821 is C21H22N2O4S2.
What is the molecular weight of BAS 01579821?
The molecular weight of BAS 01579821 is 430.10 g/mol.
Where can I buy BAS 01579821?
You can request a quote for BAS 01579821 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01579821?
Yes, KEHONG BIO provides custom synthesis services for BAS 01579821 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.