2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine
TL;DR: 2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine (CAS 74148-61-1) is a chemical compound with molecular formula C16H15NS and molecular weight 253.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine
Also Known As: 2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine, NCI60_013857, 1,5-Benzothiazepine, 2,3-dihydro-2-methyl-4-phenyl-, 2,3-Dihydro-2-methyl-4-phenyl-1,5-benzothiazepine
| Molecular Formula | C16H15NS |
|---|---|
| Molecular Weight | 253.09 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 37.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.09251 |
| Heavy Atoms | 18 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 74148-61-1 |
|---|---|
| SMILES | CC1CC(=NC2=CC=CC=C2S1)C3=CC=CC=C3 |
| InChIKey | NBRFYVLJPCZJNZ-UHFFFAOYSA-N |
Product Overview
2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine (CAS 74148-61-1), with molecular formula C16H15NS and molecular weight 253.09 g/mol. IUPAC: 2-methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine.
Chemical Property Profile of 2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine
Property Insights of 2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine
The XLogP value of 4.0 indicates that 2-Methyl-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 37.7 Ų, 2-Methyl-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-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine has 0 hydrogen bond donor(s) and 2 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 2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine?
The CAS number of 2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine is 74148-61-1.
What is the molecular formula of 2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine?
The molecular formula of 2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine is C16H15NS.
What is the molecular weight of 2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine?
The molecular weight of 2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine is 253.09 g/mol.
Where can I buy 2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine?
You can request a quote for 2-Methyl-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-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-4-phenyl-2,3-dihydro-1,5-benzothiazepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.