Phenanthro(4,5-bcd)thiophene
TL;DR: Phenanthro(4,5-bcd)thiophene (CAS 30796-92-0) is a chemical compound with molecular formula C14H8S and molecular weight 208.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1,3,5(14),6,8(13),9,11-heptaene
Also Known As: Phenanthro[4,5-bcd]thiophene, TRIBENZOTHIOPHENE, 4,5-Thiophenanthrene, Phenanthro(4,5-bcd)thiophene, [4,5-bcd]phenanthrothiophene
| Molecular Formula | C14H8S |
|---|---|
| Molecular Weight | 208.03 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.03467 |
| Heavy Atoms | 15 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 30796-92-0 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)SC4=CC=CC(=C43)C=C2 |
| InChIKey | VFUBXBLVICASPS-UHFFFAOYSA-N |
Product Overview
Phenanthro(4,5-bcd)thiophene (CAS 30796-92-0), with molecular formula C14H8S and molecular weight 208.03 g/mol. IUPAC: 15-thiatetracyclo[10.2.1.05,14.08,13]pentadeca-1,3,5(14),6,8(13),9,11-heptaene.
Chemical Property Profile of Phenanthro(4,5-bcd)thiophene
Property Insights of Phenanthro(4,5-bcd)thiophene
The XLogP value of 4.9 indicates that Phenanthro(4,5-bcd)thiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, Phenanthro(4,5-bcd)thiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenanthro(4,5-bcd)thiophene has 0 hydrogen bond donor(s) and 1 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 Phenanthro(4,5-bcd)thiophene?
The CAS number of Phenanthro(4,5-bcd)thiophene is 30796-92-0.
What is the molecular formula of Phenanthro(4,5-bcd)thiophene?
The molecular formula of Phenanthro(4,5-bcd)thiophene is C14H8S.
What is the molecular weight of Phenanthro(4,5-bcd)thiophene?
The molecular weight of Phenanthro(4,5-bcd)thiophene is 208.03 g/mol.
Where can I buy Phenanthro(4,5-bcd)thiophene?
You can request a quote for Phenanthro(4,5-bcd)thiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenanthro(4,5-bcd)thiophene?
Yes, KEHONG BIO provides custom synthesis services for Phenanthro(4,5-bcd)thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.