Phenothiaselenin, octafluoro-
TL;DR: Phenothiaselenin, octafluoro- (CAS 19638-34-7) is a chemical compound with molecular formula C12F8SSe and molecular weight 407.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,6,7,8,9-octafluorobenzo[b][1,4]benzothiaselenine
Also Known As: Phenothiaselenin, octafluoro-, Octafluorophenothiaselenin, 1,2,3,4,6,7,8,9-octafluorobenzo[b][1,4]benzothiaselenine, 1,2,3,4,6,7,8,9-Octafluorophenothiaselenine #, octafluoro-2-thia-9-selenatricyclo[8.4.0.03,8]tetradeca-1(14),3,5,7,10,12-hexaene
| Molecular Formula | C12F8SSe |
|---|---|
| Molecular Weight | 407.88 g/mol |
| LogP | 2.919 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 0 |
| Exact Mass | 407.87582 |
| Heavy Atoms | 22 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 19638-34-7 |
|---|---|
| SMILES | C1(=C(C(=C2C(=C1F)SC3=C(C(=C(C(=C3[Se]2)F)F)F)F)F)F)F |
| InChIKey | XYKMDOPSGZWVHN-UHFFFAOYSA-N |
Product Overview
Phenothiaselenin, octafluoro- (CAS 19638-34-7), with molecular formula C12F8SSe and molecular weight 407.88 g/mol. IUPAC: 1,2,3,4,6,7,8,9-octafluorobenzo[b][1,4]benzothiaselenine.
Chemical Property Profile of Phenothiaselenin, octafluoro-
Property Insights of Phenothiaselenin, octafluoro-
The XLogP value of 2.919 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenothiaselenin, octafluoro-. With a topological polar surface area (TPSA) of 25.3 Ų, Phenothiaselenin, octafluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenothiaselenin, octafluoro- has 0 hydrogen bond donor(s) and 9 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 Phenothiaselenin, octafluoro-?
The CAS number of Phenothiaselenin, octafluoro- is 19638-34-7.
What is the molecular formula of Phenothiaselenin, octafluoro-?
The molecular formula of Phenothiaselenin, octafluoro- is C12F8SSe.
What is the molecular weight of Phenothiaselenin, octafluoro-?
The molecular weight of Phenothiaselenin, octafluoro- is 407.88 g/mol.
Where can I buy Phenothiaselenin, octafluoro-?
You can request a quote for Phenothiaselenin, octafluoro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenothiaselenin, octafluoro-?
Yes, KEHONG BIO provides custom synthesis services for Phenothiaselenin, octafluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.