1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)-
TL;DR: 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)- (CAS 361375-26-0) is a chemical compound with molecular formula C15H12ClNOS and molecular weight 289.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chlorophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one
Also Known As: 2-(3-Chlorophenyl)-2,3-dihydrobenzo[b][1,4]thiazepin-4(5H)-one, A2388/0101043, 2-(3-Chlorophenyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one, 2-(3-chlorophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one, 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)-
| Molecular Formula | C15H12ClNOS |
|---|---|
| Molecular Weight | 289.03 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 289.0328 |
| Heavy Atoms | 19 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 361375-26-0 |
|---|---|
| SMILES | C1C(SC2=CC=CC=C2NC1=O)C3=CC(=CC=C3)Cl |
| InChIKey | RTNIBKIWELCLBZ-UHFFFAOYSA-N |
Product Overview
1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)- (CAS 361375-26-0), with molecular formula C15H12ClNOS and molecular weight 289.03 g/mol. IUPAC: 2-(3-chlorophenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-one.
Chemical Property Profile of 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)-
Property Insights of 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)-
The XLogP value of 3.5 indicates that 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)- has 1 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 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)-?
The CAS number of 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)- is 361375-26-0.
What is the molecular formula of 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)-?
The molecular formula of 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)- is C15H12ClNOS.
What is the molecular weight of 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)-?
The molecular weight of 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)- is 289.03 g/mol.
Where can I buy 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)-?
You can request a quote for 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-2-(3-chlorophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.