![2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one structure](/static/products/3758/375834-71-2.webp)
2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one
TL;DR: 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one (CAS 375834-71-2) is a chemical compound with molecular formula C24H31N3OS2 and molecular weight 441.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3-methylbutylsulfanyl)-4-(4-methylphenyl)-11-propyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one, 2-(isopentylthio)-7-propyl-3-(p-tolyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 2-[(3-methylbutyl)sulfanyl]-3-(4-methylphenyl)-7-propyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C24H31N3OS2 |
|---|---|
| Molecular Weight | 441.19 g/mol |
| LogP | 5.66192 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 441.19086 |
| Heavy Atoms | 30 |
| Complexity | 1082.5095 |
Chemical Identifiers
| CAS Number | 375834-71-2 |
|---|---|
| SMILES | CCCN1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCCC(C)C)C4=CC=C(C=C4)C |
Product Overview
2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one (CAS 375834-71-2), with molecular formula C24H31N3OS2 and molecular weight 441.19 g/mol. IUPAC: 5-(3-methylbutylsulfanyl)-4-(4-methylphenyl)-11-propyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
Chemical Property Profile of 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one
Property Insights of 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one
The XLogP value of 5.66192 indicates that 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.13 Ų, 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one has 0 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 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one?
The CAS number of 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one is 375834-71-2.
What is the molecular formula of 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one?
The molecular formula of 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one is C24H31N3OS2.
What is the molecular weight of 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one?
The molecular weight of 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one is 441.19 g/mol.
Where can I buy 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one?
You can request a quote for 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]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 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-methylbutylsulfanyl)-3-(4-methylphenyl)-7-propyl-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.