F1080-0005
TL;DR: F1080-0005 (CAS 369392-54-1) is a chemical compound with molecular formula C20H20N2O3S2 and molecular weight 400.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[5,6-dimethyl-4-oxo-2-[(E)-3-phenylprop-2-enyl]sulfanylthieno[2,3-d]pyrimidin-3-yl]acetate
Also Known As: F1080-0005, (E)-methyl 2-(2-(cinnamylthio)-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetate, methyl 2-(5,6-dimethyl-4-oxo-2-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-3H,4H-thieno[2,3-d]pyrimidin-3-yl)acetate, methyl 2-[5,6-dimethyl-4-oxo-2-[(E)-3-phenylprop-2-enyl]sulfanylthieno[2,3-d]pyrimidin-3-yl]acetate, methyl [5,6-dimethyl-4-oxo-2-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}thieno[2,3-d]pyrimidin-3(4H)-yl]acetate
| Molecular Formula | C20H20N2O3S2 |
|---|---|
| Molecular Weight | 400.09 g/mol |
| LogP | 4.05334 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.09152 |
| Heavy Atoms | 27 |
| Complexity | 1052.5143 |
Chemical Identifiers
| CAS Number | 369392-54-1 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)N(C(=N2)SC/C=C/C3=CC=CC=C3)CC(=O)OC)C |
Product Overview
F1080-0005 (CAS 369392-54-1), with molecular formula C20H20N2O3S2 and molecular weight 400.09 g/mol. IUPAC: methyl 2-[5,6-dimethyl-4-oxo-2-[(E)-3-phenylprop-2-enyl]sulfanylthieno[2,3-d]pyrimidin-3-yl]acetate.
Chemical Property Profile of F1080-0005
Property Insights of F1080-0005
The XLogP value of 4.05334 indicates that F1080-0005 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for F1080-0005. Following Lipinski's Rule of Five, F1080-0005 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 F1080-0005?
The CAS number of F1080-0005 is 369392-54-1.
What is the molecular formula of F1080-0005?
The molecular formula of F1080-0005 is C20H20N2O3S2.
What is the molecular weight of F1080-0005?
The molecular weight of F1080-0005 is 400.09 g/mol.
Where can I buy F1080-0005?
You can request a quote for F1080-0005 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1080-0005?
Yes, KEHONG BIO provides custom synthesis services for F1080-0005 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.