N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide
TL;DR: N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide (CAS 852046-33-4) is a chemical compound with molecular formula C17H13N3O2S2 and molecular weight 355.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide
Also Known As: N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide, AT-057/43348306, N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3(2H)-yl)propanamide, N-benzothiazol-2-yl-3-(2-oxo(3-hydrobenzothiazol-3-yl))propanamide, N-(1,3-benzothiazol-2-yl)-3-(2-keto-1,3-benzothiazol-3-yl)propionamide
| Molecular Formula | C17H13N3O2S2 |
|---|---|
| Molecular Weight | 355.04 g/mol |
| LogP | 3.7015 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 355.04492 |
| Heavy Atoms | 24 |
| Complexity | 1060.8099 |
Chemical Identifiers
| CAS Number | 852046-33-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)CCN3C4=CC=CC=C4SC3=O |
Product Overview
N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide (CAS 852046-33-4), with molecular formula C17H13N3O2S2 and molecular weight 355.04 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide.
Chemical Property Profile of N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide
Property Insights of N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide
The XLogP value of 3.7015 indicates that N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide. Following Lipinski's Rule of Five, N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide 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)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide?
The CAS number of N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide is 852046-33-4.
What is the molecular formula of N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide?
The molecular formula of N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide is C17H13N3O2S2.
What is the molecular weight of N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide?
The molecular weight of N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide is 355.04 g/mol.
Where can I buy N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide?
You can request a quote for N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide 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)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzothiazol-2-yl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.