4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine
TL;DR: 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine (CAS 775243-51-1) is a chemical compound with molecular formula C10H20N2S and molecular weight 200.13 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
Also Known As: Maybridge1_000737, 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine, 1H-1,3-Diazepine, 4,5,6,7-tetrahydro-4,4,7,7-tetramethyl-2-(methylthio)- (9CI)
| Molecular Formula | C10H20N2S |
|---|---|
| Molecular Weight | 200.13 g/mol |
| LogP | 2.646 |
| Topological Polar Surface Area | 24.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 200.13472 |
| Heavy Atoms | 13 |
| Complexity | 218.96463 |
Chemical Identifiers
| CAS Number | 775243-51-1 |
|---|---|
| SMILES | CC1(CCC(N=C(N1)SC)(C)C)C |
Product Overview
4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine (CAS 775243-51-1), with molecular formula C10H20N2S and molecular weight 200.13 g/mol. IUPAC: 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine.
Chemical Property Profile of 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine
Property Insights of 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine
The XLogP value of 2.646 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine. With a topological polar surface area (TPSA) of 24.39 Ų, 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine 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-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine?
The CAS number of 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine is 775243-51-1.
What is the molecular formula of 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine?
The molecular formula of 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine is C10H20N2S.
What is the molecular weight of 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine?
The molecular weight of 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine is 200.13 g/mol.
Where can I buy 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine?
You can request a quote for 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine 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-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine?
Yes, KEHONG BIO provides custom synthesis services for 4,4,7,7-tetramethyl-2-methylsulfanyl-5,6-dihydro-1H-1,3-diazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.