7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine
TL;DR: 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine (CAS 130336-76-4) is a chemical compound with molecular formula C10H10ClNS2 and molecular weight 242.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine
Also Known As: 12N-386S, 7-chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine, 7-chloro-2,3-dihydro-1,5-benzothiazepin-4-yl methyl sulfide, 7-chloro-4-(methylsulfanyl)-2,3-dihydro-1,5-benzothiazepine, 1,5-Benzothiazepine, 7-chloro-2,3-dihydro-4-(methylthio)-
| Molecular Formula | C10H10ClNS2 |
|---|---|
| Molecular Weight | 242.99 g/mol |
| LogP | 4.2288 |
| Topological Polar Surface Area | 12.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 242.99432 |
| Heavy Atoms | 14 |
| Complexity | 376.3848 |
Chemical Identifiers
| CAS Number | 130336-76-4 |
|---|---|
| SMILES | CSC1=NC2=C(C=CC(=C2)Cl)SCC1 |
Product Overview
7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine (CAS 130336-76-4), with molecular formula C10H10ClNS2 and molecular weight 242.99 g/mol. IUPAC: 7-chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine.
Chemical Property Profile of 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine
Property Insights of 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine
The XLogP value of 4.2288 indicates that 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.36 Ų, 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine has 0 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 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine?
The CAS number of 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine is 130336-76-4.
What is the molecular formula of 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine?
The molecular formula of 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine is C10H10ClNS2.
What is the molecular weight of 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine?
The molecular weight of 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine is 242.99 g/mol.
Where can I buy 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine?
You can request a quote for 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine?
Yes, KEHONG BIO provides custom synthesis services for 7-Chloro-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.