InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6
TL;DR: InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6 (CAS 25252-31-7) is a chemical compound with molecular formula C10H6S and molecular weight 158.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-thiatricyclo[5.4.0.02,6]undeca-1(11),2,5,7,9-pentaene
Also Known As: cBCT, Benzo[3,4]cyclobuta[1,2-c]thiophene, J1.659.961A, 4-thiatricyclo[5.4.0.02,6]undeca-1(11),2,5,7,9-pentaene, InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6
| Molecular Formula | C10H6S |
|---|---|
| Molecular Weight | 158.02 g/mol |
| LogP | 3.3955 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 158.01903 |
| Heavy Atoms | 11 |
| Complexity | 374.81607 |
Chemical Identifiers
| CAS Number | 25252-31-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=CSC=C23 |
Product Overview
InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6 (CAS 25252-31-7), with molecular formula C10H6S and molecular weight 158.02 g/mol. IUPAC: 4-thiatricyclo[5.4.0.02,6]undeca-1(11),2,5,7,9-pentaene.
Chemical Property Profile of InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6
Property Insights of InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6
The XLogP value of 3.3955 indicates that InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6 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 InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6?
The CAS number of InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6 is 25252-31-7.
What is the molecular formula of InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6?
The molecular formula of InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6 is C10H6S.
What is the molecular weight of InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6?
The molecular weight of InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6 is 158.02 g/mol.
Where can I buy InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6?
You can request a quote for InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6?
Yes, KEHONG BIO provides custom synthesis services for InChI=1/C10H6S/c1-2-4-8-7(3-1)9-5-11-6-10(8)9/h1-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.