![8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one structure](/static/products/211/211244-94-9.png)
8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one
TL;DR: 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one (CAS 211244-94-9) is a chemical compound with molecular formula C11H13N3OS and molecular weight 235.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanyl-8-propan-2-ylpyrido[2,3-d]pyrimidin-7-one
Also Known As: 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one, AO-638/40907409, S14-0058, 8-isopropyl-2-methylsulfanyl-8H-pyrido[2,3-d]pyrimidin-7-one, 2-methylsulfanyl-8-propan-2-ylpyrido[2,3-d]pyrimidin-7-one
| Molecular Formula | C11H13N3OS |
|---|---|
| Molecular Weight | 235.08 g/mol |
| LogP | 2.0943 |
| Topological Polar Surface Area | 47.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.07793 |
| Heavy Atoms | 16 |
| Complexity | 576.94165 |
Chemical Identifiers
| CAS Number | 211244-94-9 |
|---|---|
| SMILES | CC(C)N1C(=O)C=CC2=CN=C(N=C21)SC |
Product Overview
8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one (CAS 211244-94-9), with molecular formula C11H13N3OS and molecular weight 235.08 g/mol. IUPAC: 2-methylsulfanyl-8-propan-2-ylpyrido[2,3-d]pyrimidin-7-one.
Chemical Property Profile of 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one
Property Insights of 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one
The XLogP value of 2.0943 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one. With a topological polar surface area (TPSA) of 47.78 Ų, 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one has 0 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 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one?
The CAS number of 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one is 211244-94-9.
What is the molecular formula of 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one?
The molecular formula of 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one is C11H13N3OS.
What is the molecular weight of 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one?
The molecular weight of 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one is 235.08 g/mol.
Where can I buy 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one?
You can request a quote for 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one?
Yes, KEHONG BIO provides custom synthesis services for 8-isopropyl-2-(methylthio)pyrido[2,3-d]pyrimidin-7(8H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.