F3394-0404
TL;DR: F3394-0404 (CAS 571156-96-2) is a chemical compound with molecular formula C21H23N3O3S2 and molecular weight 429.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(azepan-1-yl)-2-oxoethyl]sulfanyl-5-(furan-2-yl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one
Also Known As: F3394-0404, 2-{[2-(azepan-1-yl)-2-oxoethyl]sulfanyl}-5-(furan-2-yl)-3-(prop-2-en-1-yl)-3H,4H-thieno[2,3-d]pyrimidin-4-one, 2-[2-(azepan-1-yl)-2-oxoethyl]sulfanyl-5-(furan-2-yl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one, 3-allyl-2-((2-(azepan-1-yl)-2-oxoethyl)thio)-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4(3H)-one, 5-allyl-6-[2-(1-azepanyl)-2-oxoethylthio]-3-(2-furyl)-1-thia-5,7-diaza-4(5H)-indenone
| Molecular Formula | C21H23N3O3S2 |
|---|---|
| Molecular Weight | 429.12 g/mol |
| LogP | 4.3987 |
| Topological Polar Surface Area | 68.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.11807 |
| Heavy Atoms | 29 |
| Complexity | 1060.9663 |
Chemical Identifiers
| CAS Number | 571156-96-2 |
|---|---|
| SMILES | C=CCN1C(=O)C2=C(N=C1SCC(=O)N3CCCCCC3)SC=C2C4=CC=CO4 |
Product Overview
F3394-0404 (CAS 571156-96-2), with molecular formula C21H23N3O3S2 and molecular weight 429.12 g/mol. IUPAC: 2-[2-(azepan-1-yl)-2-oxoethyl]sulfanyl-5-(furan-2-yl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of F3394-0404
Property Insights of F3394-0404
The XLogP value of 4.3987 indicates that F3394-0404 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.34 Ų falls within the moderate polarity range, balancing permeability and solubility for F3394-0404. Following Lipinski's Rule of Five, F3394-0404 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 F3394-0404?
The CAS number of F3394-0404 is 571156-96-2.
What is the molecular formula of F3394-0404?
The molecular formula of F3394-0404 is C21H23N3O3S2.
What is the molecular weight of F3394-0404?
The molecular weight of F3394-0404 is 429.12 g/mol.
Where can I buy F3394-0404?
You can request a quote for F3394-0404 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3394-0404?
Yes, KEHONG BIO provides custom synthesis services for F3394-0404 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.