BAS 02376423
TL;DR: BAS 02376423 (CAS 335220-84-3) is a chemical compound with molecular formula C17H13N3OS2 and molecular weight 339.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(12-oxo-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetonitrile
Also Known As: BAS 02376423, [(4-oxo-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetonitrile, 2-((4-oxo-3-phenyl-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetonitrile, 2-(4-oxo-3-phenyl-3,5,6,7-tetrahydrocyclopenta[2,1-d]pyrimidino[4,5-b]thiophen -2-ylthio)ethanenitrile
| Molecular Formula | C17H13N3OS2 |
|---|---|
| Molecular Weight | 339.05 g/mol |
| LogP | 3.55158 |
| Topological Polar Surface Area | 58.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.05002 |
| Heavy Atoms | 23 |
| Complexity | 982.9716 |
Chemical Identifiers
| CAS Number | 335220-84-3 |
|---|---|
| SMILES | C1CC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC#N)C4=CC=CC=C4 |
Product Overview
BAS 02376423 (CAS 335220-84-3), with molecular formula C17H13N3OS2 and molecular weight 339.05 g/mol. IUPAC: 2-[(12-oxo-11-phenyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanyl]acetonitrile.
Chemical Property Profile of BAS 02376423
Property Insights of BAS 02376423
The XLogP value of 3.55158 indicates that BAS 02376423 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.68 Ų, BAS 02376423 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 02376423 has 0 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 02376423?
The CAS number of BAS 02376423 is 335220-84-3.
What is the molecular formula of BAS 02376423?
The molecular formula of BAS 02376423 is C17H13N3OS2.
What is the molecular weight of BAS 02376423?
The molecular weight of BAS 02376423 is 339.05 g/mol.
Where can I buy BAS 02376423?
You can request a quote for BAS 02376423 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02376423?
Yes, KEHONG BIO provides custom synthesis services for BAS 02376423 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.