N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide
TL;DR: N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide (CAS 121189-73-9) is a chemical compound with molecular formula C17H16N2OS and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-4-phenylbutanamide
Also Known As: N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide, 2-Aminobenzothiazole, N-(4-phenyl)butyryl-, 2-[(1-Oxo-4-phenylbutyl)amino]-benzothiazole, N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide #, Cambridge id 6636208
| Molecular Formula | C17H16N2OS |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.09833 |
| Heavy Atoms | 21 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 121189-73-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCC(=O)NC2=NC3=CC=CC=C3S2 |
| InChIKey | GOHHKSNSVYCJCS-UHFFFAOYSA-N |
Product Overview
N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide (CAS 121189-73-9), with molecular formula C17H16N2OS and molecular weight 296.10 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-4-phenylbutanamide.
Chemical Property Profile of N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide
Property Insights of N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide
The XLogP value of 4.1 indicates that N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide. Following Lipinski's Rule of Five, N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide has 1 hydrogen bond donor(s) and 3 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 N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide?
The CAS number of N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide is 121189-73-9.
What is the molecular formula of N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide?
The molecular formula of N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide is C17H16N2OS.
What is the molecular weight of N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide?
The molecular weight of N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide is 296.10 g/mol.
Where can I buy N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide?
You can request a quote for N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-Benzothiazol-2-yl)-4-phenylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.