4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide
TL;DR: 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide (CAS 99347-30-5) is a chemical compound with molecular formula C10H21IN2S and molecular weight 328.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine;hydroiodide
Also Known As: 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide, 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine Hydroiodide, 4,5,6,7-tetrahydro-4,4,7,7-tetramethyl-2-methylthio-1H-1,3-diazepine, hydroiodide, 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine;hydroiodide
| Molecular Formula | C10H21IN2S |
|---|---|
| Molecular Weight | 328.05 g/mol |
| LogP | 3.264 |
| Topological Polar Surface Area | 24.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 328.04703 |
| Heavy Atoms | 14 |
| Complexity | 224.16188 |
Chemical Identifiers
| CAS Number | 99347-30-5 |
|---|---|
| SMILES | CC1(CCC(N=C(N1)SC)(C)C)C.I |
Product Overview
4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide (CAS 99347-30-5), with molecular formula C10H21IN2S and molecular weight 328.05 g/mol. IUPAC: 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine;hydroiodide.
Chemical Property Profile of 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide
Property Insights of 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide
The XLogP value of 3.264 indicates that 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.39 Ų, 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide has 1 hydrogen bond donor(s) and 3 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 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide?
The CAS number of 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide is 99347-30-5.
What is the molecular formula of 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide?
The molecular formula of 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide is C10H21IN2S.
What is the molecular weight of 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide?
The molecular weight of 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide is 328.05 g/mol.
Where can I buy 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide?
You can request a quote for 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide?
Yes, KEHONG BIO provides custom synthesis services for 4,4,7,7-tetramethyl-2-(methylthio)-4,5,6,7-tetrahydro-1H-1,3-diazepine hydroiodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.