F1008-0086
TL;DR: F1008-0086 (CAS 380339-90-2) is a chemical compound with molecular formula C22H24N2O2S2 and molecular weight 412.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,3-dimethyl-2-oxobutyl)sulfanyl-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: F1008-0086, 5-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-phenyl-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one, 2-((3,3-dimethyl-2-oxobutyl)thio)-3-phenyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C22H24N2O2S2 |
|---|---|
| Molecular Weight | 412.13 g/mol |
| LogP | 5.0333 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.12793 |
| Heavy Atoms | 28 |
| Complexity | 1091.6527 |
Chemical Identifiers
| CAS Number | 380339-90-2 |
|---|---|
| SMILES | CC(C)(C)C(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=CC=C4 |
Product Overview
F1008-0086 (CAS 380339-90-2), with molecular formula C22H24N2O2S2 and molecular weight 412.13 g/mol. IUPAC: 2-(3,3-dimethyl-2-oxobutyl)sulfanyl-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of F1008-0086
Property Insights of F1008-0086
The XLogP value of 5.0333 indicates that F1008-0086 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, F1008-0086 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1008-0086 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1008-0086?
The CAS number of F1008-0086 is 380339-90-2.
What is the molecular formula of F1008-0086?
The molecular formula of F1008-0086 is C22H24N2O2S2.
What is the molecular weight of F1008-0086?
The molecular weight of F1008-0086 is 412.13 g/mol.
Where can I buy F1008-0086?
You can request a quote for F1008-0086 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1008-0086?
Yes, KEHONG BIO provides custom synthesis services for F1008-0086 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.