BAS 02287939
TL;DR: BAS 02287939 (CAS 351007-36-8) is a chemical compound with molecular formula C18H18N2OS2 and molecular weight 342.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-phenylethyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: BAS 02287939, UPCMLD0ENAT0512-2439:001, 4-(2-Phenylethyl)-5-sulfanyl-8-thia-4,6-diazatricyclo[7.4.0.0,2,7]trideca-1(9),2(7),5-trien-3-one, 2-Mercapto-3-phenethyl-5,6,7,8-tetrahydro-3H-benzo[4,5]thieno[2,3-d]pyrimidin-4-one, 3-(2-phenylethyl)-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C18H18N2OS2 |
|---|---|
| Molecular Weight | 342.09 g/mol |
| LogP | 4.24209 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.08606 |
| Heavy Atoms | 23 |
| Complexity | 966.33563 |
Chemical Identifiers
| CAS Number | 351007-36-8 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)NC(=S)N(C3=O)CCC4=CC=CC=C4 |
Product Overview
BAS 02287939 (CAS 351007-36-8), with molecular formula C18H18N2OS2 and molecular weight 342.09 g/mol. IUPAC: 3-(2-phenylethyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of BAS 02287939
Property Insights of BAS 02287939
The XLogP value of 4.24209 indicates that BAS 02287939 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.79 Ų, BAS 02287939 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 02287939 has 1 hydrogen bond donor(s) and 3 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 02287939?
The CAS number of BAS 02287939 is 351007-36-8.
What is the molecular formula of BAS 02287939?
The molecular formula of BAS 02287939 is C18H18N2OS2.
What is the molecular weight of BAS 02287939?
The molecular weight of BAS 02287939 is 342.09 g/mol.
Where can I buy BAS 02287939?
You can request a quote for BAS 02287939 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02287939?
Yes, KEHONG BIO provides custom synthesis services for BAS 02287939 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.