N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide
TL;DR: N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide (CAS 78221-01-9) is a chemical compound with molecular formula C24H17N3O3S and molecular weight 427.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide
Also Known As: BAS 03775032, N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide, AB00115178-01, AE-641/40793067, BRD-A90330237-001-01-2
| Molecular Formula | C24H17N3O3S |
|---|---|
| Molecular Weight | 427.10 g/mol |
| LogP | 4.1423 |
| Topological Polar Surface Area | 79.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 427.09906 |
| Heavy Atoms | 31 |
| Complexity | 1247.9209 |
Chemical Identifiers
| CAS Number | 78221-01-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(C(=O)NC2=NC3=CC=CC=C3S2)N4C(=O)C5=CC=CC=C5C4=O |
Product Overview
N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide (CAS 78221-01-9), with molecular formula C24H17N3O3S and molecular weight 427.10 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide.
Chemical Property Profile of N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide
Property Insights of N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide
The XLogP value of 4.1423 indicates that N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.37 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide. Following Lipinski's Rule of Five, N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide has 1 hydrogen bond donor(s) and 5 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)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide?
The CAS number of N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide is 78221-01-9.
What is the molecular formula of N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide?
The molecular formula of N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide is C24H17N3O3S.
What is the molecular weight of N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide?
The molecular weight of N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide is 427.10 g/mol.
Where can I buy N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide?
You can request a quote for N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide 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)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzothiazol-2-yl)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.