N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide
TL;DR: N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide (CAS 313660-18-3) is a chemical compound with molecular formula C12H13N3O2S and molecular weight 263.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide
Also Known As: N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide, BAS 08894178, N-(6-Acetylamino-benzothiazol-2-yl)-propionamide, N-(6-acetamidobenzo[d]thiazol-2-yl)propionamide, N-[6-(acetylamino)benzothiazol-2-yl]propanamide
| Molecular Formula | C12H13N3O2S |
|---|---|
| Molecular Weight | 263.07 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 99.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.07285 |
| Heavy Atoms | 18 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 313660-18-3 |
|---|---|
| SMILES | CCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C |
| InChIKey | XAZAVEARZSPUPR-UHFFFAOYSA-N |
Product Overview
N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide (CAS 313660-18-3), with molecular formula C12H13N3O2S and molecular weight 263.07 g/mol. IUPAC: N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide.
Chemical Property Profile of N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide
Property Insights of N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide. The TPSA of 99.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide. Following Lipinski's Rule of Five, N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide has 2 hydrogen bond donor(s) and 4 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-(6-acetamido-1,3-benzothiazol-2-yl)propanamide?
The CAS number of N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide is 313660-18-3.
What is the molecular formula of N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide?
The molecular formula of N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide is C12H13N3O2S.
What is the molecular weight of N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide?
The molecular weight of N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide is 263.07 g/mol.
Where can I buy N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide?
You can request a quote for N-(6-acetamido-1,3-benzothiazol-2-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-(6-acetamido-1,3-benzothiazol-2-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-acetamido-1,3-benzothiazol-2-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.