BAS 00700359
TL;DR: BAS 00700359 (CAS 328072-81-7) is a chemical compound with molecular formula C20H26N2O3S2 and molecular weight 406.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3-cyclohexyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Also Known As: BAS 00700359, BIM-0013714.P001, AB00093412-01, ethyl [(3-cyclohexyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate, ethyl 2-((3-cyclohexyl-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate
| Molecular Formula | C20H26N2O3S2 |
|---|---|
| Molecular Weight | 406.14 g/mol |
| LogP | 4.4972 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.1385 |
| Heavy Atoms | 27 |
| Complexity | 896.7444 |
Chemical Identifiers
| CAS Number | 328072-81-7 |
|---|---|
| SMILES | CCOC(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4CCCCC4 |
Product Overview
BAS 00700359 (CAS 328072-81-7), with molecular formula C20H26N2O3S2 and molecular weight 406.14 g/mol. IUPAC: ethyl 2-[(3-cyclohexyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetate.
Chemical Property Profile of BAS 00700359
Property Insights of BAS 00700359
The XLogP value of 4.4972 indicates that BAS 00700359 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00700359. Following Lipinski's Rule of Five, BAS 00700359 has 0 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 00700359?
The CAS number of BAS 00700359 is 328072-81-7.
What is the molecular formula of BAS 00700359?
The molecular formula of BAS 00700359 is C20H26N2O3S2.
What is the molecular weight of BAS 00700359?
The molecular weight of BAS 00700359 is 406.14 g/mol.
Where can I buy BAS 00700359?
You can request a quote for BAS 00700359 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00700359?
Yes, KEHONG BIO provides custom synthesis services for BAS 00700359 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.