4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine
TL;DR: 4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine (CAS 64820-39-9) is a chemical compound with molecular formula C22H19NS and molecular weight 329.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine
Also Known As: 4-(4-methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine, 4H,6H-Thieno<3,4-d>furoxan, J1.969.454B, AE-848/37316016, 1,5-Benzothiazepine, 2,3-dihydro-4-(4-methylphenyl)-2-phenyl-
| Molecular Formula | C22H19NS |
|---|---|
| Molecular Weight | 329.12 g/mol |
| LogP | 6.35292 |
| Topological Polar Surface Area | 12.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 329.1238 |
| Heavy Atoms | 24 |
| Complexity | 865.98645 |
Chemical Identifiers
| CAS Number | 64820-39-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC3=CC=CC=C3SC(C2)C4=CC=CC=C4 |
Product Overview
4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine (CAS 64820-39-9), with molecular formula C22H19NS and molecular weight 329.12 g/mol. IUPAC: 4-(4-methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine.
Chemical Property Profile of 4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine
Property Insights of 4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine
The XLogP value of 6.35292 indicates that 4-(4-Methylphenyl)-2-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, 4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Methylphenyl)-2-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 4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine?
The CAS number of 4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine is 64820-39-9.
What is the molecular formula of 4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine?
The molecular formula of 4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine is C22H19NS.
What is the molecular weight of 4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine?
The molecular weight of 4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine is 329.12 g/mol.
Where can I buy 4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine?
You can request a quote for 4-(4-Methylphenyl)-2-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 4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methylphenyl)-2-phenyl-2,3-dihydro-1,5-benzothiazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.