BAS 02170895
TL;DR: BAS 02170895 (CAS 333318-92-6) is a chemical compound with molecular formula C21H23N3O3S2 and molecular weight 429.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Also Known As: BAS 02170895, 2-[(3-ethyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide, 2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide, 2-((3-ethyl-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N-(4-methoxyphenyl)acetamide, 2-({4-ethyl-3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl}sulfanyl)-N-(4-methoxyphenyl)acetamide
| Molecular Formula | C21H23N3O3S2 |
|---|---|
| Molecular Weight | 429.12 g/mol |
| LogP | 4.0961 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.11807 |
| Heavy Atoms | 29 |
| Complexity | 1103.0422 |
Chemical Identifiers
| CAS Number | 333318-92-6 |
|---|---|
| SMILES | CCN1C(=O)C2=C(N=C1SCC(=O)NC3=CC=C(C=C3)OC)SC4=C2CCCC4 |
Product Overview
BAS 02170895 (CAS 333318-92-6), with molecular formula C21H23N3O3S2 and molecular weight 429.12 g/mol. IUPAC: 2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide.
Chemical Property Profile of BAS 02170895
Property Insights of BAS 02170895
The XLogP value of 4.0961 indicates that BAS 02170895 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02170895. Following Lipinski's Rule of Five, BAS 02170895 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 02170895?
The CAS number of BAS 02170895 is 333318-92-6.
What is the molecular formula of BAS 02170895?
The molecular formula of BAS 02170895 is C21H23N3O3S2.
What is the molecular weight of BAS 02170895?
The molecular weight of BAS 02170895 is 429.12 g/mol.
Where can I buy BAS 02170895?
You can request a quote for BAS 02170895 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02170895?
Yes, KEHONG BIO provides custom synthesis services for BAS 02170895 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.