2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide
TL;DR: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide (CAS 693237-72-8) is a chemical compound with molecular formula C17H15ClN2OS2 and molecular weight 362.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide
Also Known As: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide
| Molecular Formula | C17H15ClN2OS2 |
|---|---|
| Molecular Weight | 362.03 g/mol |
| LogP | 5.4591 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.03143 |
| Heavy Atoms | 23 |
| Complexity | 783.83124 |
Chemical Identifiers
| CAS Number | 693237-72-8 |
|---|---|
| SMILES | CCC(C(=O)NC1=CC=C(C=C1)Cl)SC2=NC3=CC=CC=C3S2 |
Product Overview
2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide (CAS 693237-72-8), with molecular formula C17H15ClN2OS2 and molecular weight 362.03 g/mol. IUPAC: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide.
Chemical Property Profile of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide
Property Insights of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide
The XLogP value of 5.4591 indicates that 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide?
The CAS number of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide is 693237-72-8.
What is the molecular formula of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide?
The molecular formula of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide is C17H15ClN2OS2.
What is the molecular weight of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide?
The molecular weight of 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide is 362.03 g/mol.
Where can I buy 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide?
You can request a quote for 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.