![N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide structure](/static/products/2890/289062-87-9.webp)
N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide
TL;DR: N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide (CAS 289062-87-9) is a chemical compound with molecular formula C11H12N2O3S2 and molecular weight 284.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide
Also Known As: TimTec1_007268, BAS 04806914, N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide, N-(6-Methanesulfonyl-benzothiazol-2-yl)-propionamide, N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide
| Molecular Formula | C11H12N2O3S2 |
|---|---|
| Molecular Weight | 284.03 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.02893 |
| Heavy Atoms | 18 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 289062-87-9 |
|---|---|
| SMILES | CCC(=O)NC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C |
| InChIKey | QMTRWJXVLYSNGV-UHFFFAOYSA-N |
Product Overview
N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide (CAS 289062-87-9), with molecular formula C11H12N2O3S2 and molecular weight 284.03 g/mol. IUPAC: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide.
Chemical Property Profile of N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide
Property Insights of N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide. Following Lipinski's Rule of Five, N-[6-(methylsulfonyl)-1,3-benzothiazol-2-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-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide?
The CAS number of N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide is 289062-87-9.
What is the molecular formula of N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide?
The molecular formula of N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide is C11H12N2O3S2.
What is the molecular weight of N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide?
The molecular weight of N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide is 284.03 g/mol.
Where can I buy N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide?
You can request a quote for N-[6-(methylsulfonyl)-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-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.