F0739-0003
TL;DR: F0739-0003 (CAS 325693-58-1) is a chemical compound with molecular formula C21H20N4O2S4 and molecular weight 488.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4,5-dimethyl-7-oxo-3,10-dithia-1,8-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,8-trien-12-yl)methylsulfanyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: F0739-0003, AF-399/14202002, 2-(((2,3-dimethyl-4-oxo-7,8-dihydro-4H-thiazolo[3,2-a]thieno[3,2-e]pyrimidin-8-yl)methyl)thio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 2-{[(2,3-dimethyl-4-oxo-7,8-dihydro-4H-[1,3]thiazolo[3,2-a]thieno[3,2-e]pyrimidin-8-yl)methyl]sulfanyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 2,3-dimethyl-8-[(4-oxo-9-thia-1,3-diaza-3,4,5,6,7,8-hexahydro-2-fluorenylthio)methyl]-1,6-dithia-5,8a-diaza-7,8-dihydro-4H-as-indacen-4-one
| Molecular Formula | C21H20N4O2S4 |
|---|---|
| Molecular Weight | 488.05 g/mol |
| LogP | 4.69074 |
| Topological Polar Surface Area | 80.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 488.0469 |
| Heavy Atoms | 31 |
| Complexity | 1479.0574 |
Chemical Identifiers
| CAS Number | 325693-58-1 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)N=C3N2C(CS3)CSC4=NC5=C(C6=C(S5)CCCC6)C(=O)N4)C |
Product Overview
F0739-0003 (CAS 325693-58-1), with molecular formula C21H20N4O2S4 and molecular weight 488.05 g/mol. IUPAC: 2-[(4,5-dimethyl-7-oxo-3,10-dithia-1,8-diazatricyclo[7.3.0.02,6]dodeca-2(6),4,8-trien-12-yl)methylsulfanyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of F0739-0003
Property Insights of F0739-0003
The XLogP value of 4.69074 indicates that F0739-0003 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.64 Ų falls within the moderate polarity range, balancing permeability and solubility for F0739-0003. Following Lipinski's Rule of Five, F0739-0003 has 1 hydrogen bond donor(s) and 8 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 F0739-0003?
The CAS number of F0739-0003 is 325693-58-1.
What is the molecular formula of F0739-0003?
The molecular formula of F0739-0003 is C21H20N4O2S4.
What is the molecular weight of F0739-0003?
The molecular weight of F0739-0003 is 488.05 g/mol.
Where can I buy F0739-0003?
You can request a quote for F0739-0003 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0739-0003?
Yes, KEHONG BIO provides custom synthesis services for F0739-0003 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.