AF-399/40851748
TL;DR: AF-399/40851748 (CAS 379238-93-4) is a chemical compound with molecular formula C16H14N2O2S3 and molecular weight 362.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-oxopropylsulfanyl)-3-prop-2-enyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one
Also Known As: AF-399/40851748, 2-(2-oxopropylsulfanyl)-3-prop-2-enyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one, 2-(2-oxopropylthio)-3-prop-2-enyl-5-(2-thienyl)-3-hydrothiopheno[2,3-d]pyrimid in-4-one, 3-allyl-2-[(2-oxopropyl)sulfanyl]-5-(2-thienyl)thieno[2,3-d]pyrimidin-4(3H)-one, 2-[(2-oxopropyl)sulfanyl]-3-(prop-2-en-1-yl)-5-(thiophen-2-yl)thieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C16H14N2O2S3 |
|---|---|
| Molecular Weight | 362.02 g/mol |
| LogP | 4.0536 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 362.02173 |
| Heavy Atoms | 23 |
| Complexity | 922.84814 |
Chemical Identifiers
| CAS Number | 379238-93-4 |
|---|---|
| SMILES | CC(=O)CSC1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1CC=C |
Product Overview
AF-399/40851748 (CAS 379238-93-4), with molecular formula C16H14N2O2S3 and molecular weight 362.02 g/mol. IUPAC: 2-(2-oxopropylsulfanyl)-3-prop-2-enyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of AF-399/40851748
Property Insights of AF-399/40851748
The XLogP value of 4.0536 indicates that AF-399/40851748 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, AF-399/40851748 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/40851748 has 0 hydrogen bond donor(s) and 6 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 AF-399/40851748?
The CAS number of AF-399/40851748 is 379238-93-4.
What is the molecular formula of AF-399/40851748?
The molecular formula of AF-399/40851748 is C16H14N2O2S3.
What is the molecular weight of AF-399/40851748?
The molecular weight of AF-399/40851748 is 362.02 g/mol.
Where can I buy AF-399/40851748?
You can request a quote for AF-399/40851748 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/40851748?
Yes, KEHONG BIO provides custom synthesis services for AF-399/40851748 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.