Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl-
TL;DR: Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl- (CAS 55849-06-4) is a chemical compound with molecular formula C10H18S and molecular weight 170.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,7,7-tetramethyl-3,6-dihydrothiepine
Also Known As: 2,2,7,7-tetramethyl-3,6-dihydrothiepine, Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl-, 2,2,7,7-tetramethyl-2,3,6,7-tetrahydrothiepine, Thiepin,2,3,6,7-tetrahydro-3,3,6,6-tetramethyl
| Molecular Formula | C10H18S |
|---|---|
| Molecular Weight | 170.11 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.11292 |
| Heavy Atoms | 11 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 55849-06-4 |
|---|---|
| SMILES | CC1(CC=CCC(S1)(C)C)C |
| InChIKey | XOYMIAXCEYKMRB-UHFFFAOYSA-N |
Product Overview
Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl- (CAS 55849-06-4), with molecular formula C10H18S and molecular weight 170.11 g/mol. IUPAC: 2,2,7,7-tetramethyl-3,6-dihydrothiepine.
Chemical Property Profile of Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl-
Property Insights of Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl-
The XLogP value of 3.3 indicates that Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl- 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 Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl-?
The CAS number of Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl- is 55849-06-4.
What is the molecular formula of Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl-?
The molecular formula of Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl- is C10H18S.
What is the molecular weight of Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl-?
The molecular weight of Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl- is 170.11 g/mol.
Where can I buy Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl-?
You can request a quote for Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl-?
Yes, KEHONG BIO provides custom synthesis services for Thiepin, 2,3,6,7-tetrahydro-3,3,6,6-tetramethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.