BAS 02054087
TL;DR: BAS 02054087 (CAS 338424-23-0) is a chemical compound with molecular formula C18H15Cl2N3OS2 and molecular weight 423.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dichlorophenyl)-2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)acetamide
Also Known As: BAS 02054087, N-(3,4-dichlorophenyl)-2-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylsulfanyl)acetamide, AF-399/40827612, N-(3,4-dichlorophenyl)-2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)acetamide, N-(3,4-dichlorophenyl)-2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)acetamide
| Molecular Formula | C18H15Cl2N3OS2 |
|---|---|
| Molecular Weight | 423.00 g/mol |
| LogP | 5.6077 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 423.00336 |
| Heavy Atoms | 26 |
| Complexity | 989.9718 |
Chemical Identifiers
| CAS Number | 338424-23-0 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=CN=C3SCC(=O)NC4=CC(=C(C=C4)Cl)Cl |
Product Overview
BAS 02054087 (CAS 338424-23-0), with molecular formula C18H15Cl2N3OS2 and molecular weight 423.00 g/mol. IUPAC: N-(3,4-dichlorophenyl)-2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)acetamide.
Chemical Property Profile of BAS 02054087
Property Insights of BAS 02054087
The XLogP value of 5.6077 indicates that BAS 02054087 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 02054087 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 02054087 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02054087?
The CAS number of BAS 02054087 is 338424-23-0.
What is the molecular formula of BAS 02054087?
The molecular formula of BAS 02054087 is C18H15Cl2N3OS2.
What is the molecular weight of BAS 02054087?
The molecular weight of BAS 02054087 is 423.00 g/mol.
Where can I buy BAS 02054087?
You can request a quote for BAS 02054087 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02054087?
Yes, KEHONG BIO provides custom synthesis services for BAS 02054087 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.