7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one
TL;DR: 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one (CAS 119260-93-4) is a chemical compound with molecular formula C16H15N3OS and molecular weight 297.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-benzyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: 7-benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one, 7-benzyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 11-benzyl-8-thia-4,6,11-triazatricyclo[7.4.0.0?,?]trideca-1(9),2(7),5-trien-3-one, 7-BENZYL-5,6,7,8-TETRAHYDRO-3H-PYRIDO[4',3':4,5]-THIENO[2,3-D]PYRIMIDIN-4-ONE, 7-Benzyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one
| Molecular Formula | C16H15N3OS |
|---|---|
| Molecular Weight | 297.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 72.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 297.0936 |
| Heavy Atoms | 21 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 119260-93-4 |
|---|---|
| SMILES | C1CN(CC2=C1C3=C(S2)N=CNC3=O)CC4=CC=CC=C4 |
| InChIKey | XIUNLLKWPRXLSS-UHFFFAOYSA-N |
Product Overview
7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one (CAS 119260-93-4), with molecular formula C16H15N3OS and molecular weight 297.09 g/mol. IUPAC: 11-benzyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
Chemical Property Profile of 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one
Property Insights of 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one. Following Lipinski's Rule of Five, 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one has 1 hydrogen bond donor(s) and 4 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 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one?
The CAS number of 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one is 119260-93-4.
What is the molecular formula of 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one?
The molecular formula of 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one is C16H15N3OS.
What is the molecular weight of 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one?
The molecular weight of 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one is 297.09 g/mol.
Where can I buy 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one?
You can request a quote for 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 7-Benzyl-3,5,6,8-tetrahydropyrido[2,3]thieno[2,4-d]pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.