Dibenzothiophene, 1,2,3,4-tetrahydro-
TL;DR: Dibenzothiophene, 1,2,3,4-tetrahydro- (CAS 16587-33-0) is a chemical compound with molecular formula C12H12S and molecular weight 188.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4-tetrahydrodibenzothiophene
Also Known As: Tetrahydrodibenzothiophene, dibenzothiophene, 1,2,3,4-tetrahydrodibenzothiophene, Dibenzothiophene, 1,2,3,4-tetrahydro-, 1,2,3,4-Tetrahydrodibenzo[b,d]thiophene
| Molecular Formula | C12H12S |
|---|---|
| Molecular Weight | 188.07 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.06598 |
| Heavy Atoms | 13 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 16587-33-0 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=CC=CC=C3S2 |
| InChIKey | JCLPOPNXITXHOR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibenzothiophene, 1,2,3,4-tetrahydro- (CAS 16587-33-0), with molecular formula C12H12S and molecular weight 188.07 g/mol. IUPAC: 1,2,3,4-tetrahydrodibenzothiophene.
Chemical Property Profile of Dibenzothiophene, 1,2,3,4-tetrahydro-
Property Insights of Dibenzothiophene, 1,2,3,4-tetrahydro-
The XLogP value of 4.2 indicates that Dibenzothiophene, 1,2,3,4-tetrahydro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.2 Ų, Dibenzothiophene, 1,2,3,4-tetrahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzothiophene, 1,2,3,4-tetrahydro- 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 Dibenzothiophene, 1,2,3,4-tetrahydro-?
The CAS number of Dibenzothiophene, 1,2,3,4-tetrahydro- is 16587-33-0.
What is the molecular formula of Dibenzothiophene, 1,2,3,4-tetrahydro-?
The molecular formula of Dibenzothiophene, 1,2,3,4-tetrahydro- is C12H12S.
What is the molecular weight of Dibenzothiophene, 1,2,3,4-tetrahydro-?
The molecular weight of Dibenzothiophene, 1,2,3,4-tetrahydro- is 188.07 g/mol.
Where can I buy Dibenzothiophene, 1,2,3,4-tetrahydro-?
You can request a quote for Dibenzothiophene, 1,2,3,4-tetrahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzothiophene, 1,2,3,4-tetrahydro-?
Yes, KEHONG BIO provides custom synthesis services for Dibenzothiophene, 1,2,3,4-tetrahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.