2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine
TL;DR: 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine (CAS 60246-85-7) is a chemical compound with molecular formula C21H16ClNS and molecular weight 349.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine
Also Known As: 2-(2-chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine, AJ-091/33279015, 1,5-Benzothiazepine, 2-(2-chlorophenyl)-2,3-dihydro-4-phenyl-, 2-(2-chloro-phenyl)-4-phenyl-2,3-dihydro-benzo[b][1,4]thiazepine
| Molecular Formula | C21H16ClNS |
|---|---|
| Molecular Weight | 349.07 g/mol |
| LogP | 6.6979 |
| Topological Polar Surface Area | 12.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 349.06918 |
| Heavy Atoms | 24 |
| Complexity | 889.1053 |
Chemical Identifiers
| CAS Number | 60246-85-7 |
|---|---|
| SMILES | C1C(SC2=CC=CC=C2N=C1C3=CC=CC=C3)C4=CC=CC=C4Cl |
Product Overview
2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine (CAS 60246-85-7), with molecular formula C21H16ClNS and molecular weight 349.07 g/mol. IUPAC: 2-(2-chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine.
Chemical Property Profile of 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine
Property Insights of 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine
The XLogP value of 6.6979 indicates that 2-(2-Chlorophenyl)-4-phenyl-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, 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine?
The CAS number of 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine is 60246-85-7.
What is the molecular formula of 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine?
The molecular formula of 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine is C21H16ClNS.
What is the molecular weight of 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine?
The molecular weight of 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine is 349.07 g/mol.
Where can I buy 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine?
You can request a quote for 2-(2-Chlorophenyl)-4-phenyl-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 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.