2-Benzo(a)anthracen-7-yl-1-benzothiophene
TL;DR: 2-Benzo(a)anthracen-7-yl-1-benzothiophene (CAS 57312-00-2) is a chemical compound with molecular formula C26H16S and molecular weight 360.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzo[a]anthracen-7-yl-1-benzothiophene
Also Known As: 2-Benzo(a)anthracen-7-yl-1-benzothiophene, 2-Benzo[a]anthracen-7-yl-1-benzothiophene, 2-(tetraphen-7-yl)benzo[b]thiophene, 2-(tetraphen-7-yl)-1-benzothiophene, 2-benzo[a]anthracen-7-ylbenzothiophene
| Molecular Formula | C26H16S |
|---|---|
| Molecular Weight | 360.10 g/mol |
| LogP | 8.4 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 360.09726 |
| Heavy Atoms | 27 |
| Complexity | 528.0 |
Chemical Identifiers
| CAS Number | 57312-00-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4C=C32)C5=CC6=CC=CC=C6S5 |
| InChIKey | PUKTVQWSIXMMPH-UHFFFAOYSA-N |
Product Overview
2-Benzo(a)anthracen-7-yl-1-benzothiophene (CAS 57312-00-2), with molecular formula C26H16S and molecular weight 360.10 g/mol. IUPAC: 2-benzo[a]anthracen-7-yl-1-benzothiophene.
Chemical Property Profile of 2-Benzo(a)anthracen-7-yl-1-benzothiophene
Property Insights of 2-Benzo(a)anthracen-7-yl-1-benzothiophene
The XLogP value of 8.4 indicates that 2-Benzo(a)anthracen-7-yl-1-benzothiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, 2-Benzo(a)anthracen-7-yl-1-benzothiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzo(a)anthracen-7-yl-1-benzothiophene has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Benzo(a)anthracen-7-yl-1-benzothiophene?
The CAS number of 2-Benzo(a)anthracen-7-yl-1-benzothiophene is 57312-00-2.
What is the molecular formula of 2-Benzo(a)anthracen-7-yl-1-benzothiophene?
The molecular formula of 2-Benzo(a)anthracen-7-yl-1-benzothiophene is C26H16S.
What is the molecular weight of 2-Benzo(a)anthracen-7-yl-1-benzothiophene?
The molecular weight of 2-Benzo(a)anthracen-7-yl-1-benzothiophene is 360.10 g/mol.
Where can I buy 2-Benzo(a)anthracen-7-yl-1-benzothiophene?
You can request a quote for 2-Benzo(a)anthracen-7-yl-1-benzothiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzo(a)anthracen-7-yl-1-benzothiophene?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzo(a)anthracen-7-yl-1-benzothiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.