F1720-0022
TL;DR: F1720-0022 (CAS 879916-50-4) is a chemical compound with molecular formula C14H15BrN2O2S2 and molecular weight 385.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-bromophenyl)-5,5-dioxo-1-prop-2-enyl-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazole-2-thione
Also Known As: F1720-0022, 1-allyl-3-(3-bromophenyl)tetrahydro-1H-thieno[3,4-d]imidazole-2(3H)-thione 5,5-dioxide, 1-(3-bromophenyl)-3-(prop-2-en-1-yl)-2-sulfanylidene-hexahydro-1H-5lambda6-thieno[3,4-d]imidazole-5,5-dione, 3-(3-bromophenyl)-5,5-dioxo-1-prop-2-enyl-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazole-2-thione, 6-(3-bromophenyl)-4-prop-2-enyl-5-thioxo-1,3,4,6,3a,6a-hexahydro-2-thia-4,6-di azapentalene-2,2-dione
| Molecular Formula | C14H15BrN2O2S2 |
|---|---|
| Molecular Weight | 385.98 g/mol |
| LogP | 2.2076 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 385.97583 |
| Heavy Atoms | 21 |
| Complexity | 704.6805 |
Chemical Identifiers
| CAS Number | 879916-50-4 |
|---|---|
| SMILES | C=CCN1C2CS(=O)(=O)CC2N(C1=S)C3=CC(=CC=C3)Br |
Product Overview
F1720-0022 (CAS 879916-50-4), with molecular formula C14H15BrN2O2S2 and molecular weight 385.98 g/mol. IUPAC: 3-(3-bromophenyl)-5,5-dioxo-1-prop-2-enyl-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazole-2-thione.
Chemical Property Profile of F1720-0022
Property Insights of F1720-0022
The XLogP value of 2.2076 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1720-0022. With a topological polar surface area (TPSA) of 40.62 Ų, F1720-0022 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1720-0022 has 0 hydrogen bond donor(s) and 3 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 F1720-0022?
The CAS number of F1720-0022 is 879916-50-4.
What is the molecular formula of F1720-0022?
The molecular formula of F1720-0022 is C14H15BrN2O2S2.
What is the molecular weight of F1720-0022?
The molecular weight of F1720-0022 is 385.98 g/mol.
Where can I buy F1720-0022?
You can request a quote for F1720-0022 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1720-0022?
Yes, KEHONG BIO provides custom synthesis services for F1720-0022 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.