F1680-0005
TL;DR: F1680-0005 (CAS 714202-26-3) is a chemical compound with molecular formula C17H15N3O5S and molecular weight 373.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-nitrophenyl)-5,5-dioxo-1-phenyl-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-2-one
Also Known As: F1680-0005, 1-(3-nitrophenyl)-3-phenyltetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one 5,5-dioxide, 3-(3-nitrophenyl)-5,5-dioxo-1-phenyl-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-2-one, 1-(3-nitrophenyl)-3-phenyl-hexahydro-1H-5lambda6-thieno[3,4-d]imidazole-2,5,5-trione, 6-(3-nitrophenyl)-4-phenyl-1,3,4,6,3a,6a-hexahydro-2-thia-4,6-diazapentalene-2 ,2,5-trione
| Molecular Formula | C17H15N3O5S |
|---|---|
| Molecular Weight | 373.07 g/mol |
| LogP | 2.207 |
| Topological Polar Surface Area | 100.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 373.07324 |
| Heavy Atoms | 26 |
| Complexity | 992.4678 |
Chemical Identifiers
| CAS Number | 714202-26-3 |
|---|---|
| SMILES | C1C2C(CS1(=O)=O)N(C(=O)N2C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
F1680-0005 (CAS 714202-26-3), with molecular formula C17H15N3O5S and molecular weight 373.07 g/mol. IUPAC: 3-(3-nitrophenyl)-5,5-dioxo-1-phenyl-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-2-one.
Chemical Property Profile of F1680-0005
Property Insights of F1680-0005
The XLogP value of 2.207 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1680-0005. The TPSA of 100.83 Ų falls within the moderate polarity range, balancing permeability and solubility for F1680-0005. Following Lipinski's Rule of Five, F1680-0005 has 0 hydrogen bond donor(s) and 5 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 F1680-0005?
The CAS number of F1680-0005 is 714202-26-3.
What is the molecular formula of F1680-0005?
The molecular formula of F1680-0005 is C17H15N3O5S.
What is the molecular weight of F1680-0005?
The molecular weight of F1680-0005 is 373.07 g/mol.
Where can I buy F1680-0005?
You can request a quote for F1680-0005 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1680-0005?
Yes, KEHONG BIO provides custom synthesis services for F1680-0005 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.