BAS 01248688
TL;DR: BAS 01248688 (CAS 332161-50-9) is a chemical compound with molecular formula C20H21N3OS2 and molecular weight 383.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dimethylphenyl)-2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)acetamide
Also Known As: BAS 01248688, N-(2,3-dimethylphenyl)-2-{8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2,4,6-tetraen-3-ylsulfanyl}acetamide, N-(2,3-dimethylphenyl)-2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)acetamide, N-(2,3-dimethylphenyl)-2-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylsulfanyl)acetamide, N-(2,3-dimethylphenyl)-2-(5,6,7,8-tetrahydrobenzo[b]thiopheno[3,2-e]pyrimidin- 4-ylthio)acetamide
| Molecular Formula | C20H21N3OS2 |
|---|---|
| Molecular Weight | 383.11 g/mol |
| LogP | 4.91774 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.1126 |
| Heavy Atoms | 26 |
| Complexity | 980.5919 |
Chemical Identifiers
| CAS Number | 332161-50-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC(=O)CSC2=NC=NC3=C2C4=C(S3)CCCC4)C |
Product Overview
BAS 01248688 (CAS 332161-50-9), with molecular formula C20H21N3OS2 and molecular weight 383.11 g/mol. IUPAC: N-(2,3-dimethylphenyl)-2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)acetamide.
Chemical Property Profile of BAS 01248688
Property Insights of BAS 01248688
The XLogP value of 4.91774 indicates that BAS 01248688 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, BAS 01248688 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01248688 has 1 hydrogen bond donor(s) and 5 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 01248688?
The CAS number of BAS 01248688 is 332161-50-9.
What is the molecular formula of BAS 01248688?
The molecular formula of BAS 01248688 is C20H21N3OS2.
What is the molecular weight of BAS 01248688?
The molecular weight of BAS 01248688 is 383.11 g/mol.
Where can I buy BAS 01248688?
You can request a quote for BAS 01248688 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01248688?
Yes, KEHONG BIO provides custom synthesis services for BAS 01248688 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.