![N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide structure](/static/products/577/577989-70-9.png)
N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide
TL;DR: N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide (CAS 577989-70-9) is a chemical compound with molecular formula C19H18N2O2S2 and molecular weight 370.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)butanamide
Also Known As: N-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)butanamide, N-(2-((2-oxo-2-phenylethyl)thio)benzo[d]thiazol-6-yl)butyramide, N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide
| Molecular Formula | C19H18N2O2S2 |
|---|---|
| Molecular Weight | 370.08 g/mol |
| LogP | 5.0099 |
| Topological Polar Surface Area | 59.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 370.08096 |
| Heavy Atoms | 25 |
| Complexity | 890.8353 |
Chemical Identifiers
| CAS Number | 577989-70-9 |
|---|---|
| SMILES | CCCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)C3=CC=CC=C3 |
Product Overview
N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide (CAS 577989-70-9), with molecular formula C19H18N2O2S2 and molecular weight 370.08 g/mol. IUPAC: N-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)butanamide.
Chemical Property Profile of N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide
Property Insights of N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide
The XLogP value of 5.0099 indicates that N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.06 Ų, N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide?
The CAS number of N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide is 577989-70-9.
What is the molecular formula of N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide?
The molecular formula of N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide is C19H18N2O2S2.
What is the molecular weight of N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide?
The molecular weight of N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide is 370.08 g/mol.
Where can I buy N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide?
You can request a quote for N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-{2-[(2-oxo-2-phenylethyl)sulfanyl]-1,3-benzothiazol-6-yl}butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.