![7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine structure](/static/products/3039/303987-75-9.webp)
7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine
TL;DR: 7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine (CAS 303987-75-9) is a chemical compound with molecular formula C16H13ClFNS2 and molecular weight 337.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-4-[(4-fluorophenyl)methylsulfanyl]-2,3-dihydro-1,5-benzothiazepine
Also Known As: 11N-391S, 7-chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine, 7-chloro-4-[(4-fluorophenyl)methylsulfanyl]-2,3-dihydro-1,5-benzothiazepine, 7-chloro-4-{[(4-fluorophenyl)methyl]sulfanyl}-2,3-dihydro-1,5-benzothiazepine
| Molecular Formula | C16H13ClFNS2 |
|---|---|
| Molecular Weight | 337.02 g/mol |
| LogP | 5.9383 |
| Topological Polar Surface Area | 12.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 337.0162 |
| Heavy Atoms | 21 |
| Complexity | 670.47723 |
Chemical Identifiers
| CAS Number | 303987-75-9 |
|---|---|
| SMILES | C1CSC2=C(C=C(C=C2)Cl)N=C1SCC3=CC=C(C=C3)F |
Product Overview
7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine (CAS 303987-75-9), with molecular formula C16H13ClFNS2 and molecular weight 337.02 g/mol. IUPAC: 7-chloro-4-[(4-fluorophenyl)methylsulfanyl]-2,3-dihydro-1,5-benzothiazepine.
Chemical Property Profile of 7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine
Property Insights of 7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine
The XLogP value of 5.9383 indicates that 7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-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-[(4-fluorobenzyl)sulfanyl]-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-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine?
The CAS number of 7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine is 303987-75-9.
What is the molecular formula of 7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine?
The molecular formula of 7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine is C16H13ClFNS2.
What is the molecular weight of 7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine?
The molecular weight of 7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine is 337.02 g/mol.
Where can I buy 7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine?
You can request a quote for 7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-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-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine?
Yes, KEHONG BIO provides custom synthesis services for 7-Chloro-4-[(4-fluorobenzyl)sulfanyl]-2,3-dihydro-1,5-benzothiazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.