![N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide structure](/static/products/670/67073-25-0.png)
N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide
TL;DR: N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide (CAS 67073-25-0) is a chemical compound with molecular formula C12H12N2O2S and molecular weight 248.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(2-oxopropyl)-1,3-benzothiazol-2-ylidene]acetamide
Also Known As: 1-(2-acetylimino-benzothiazol-3-yl)-propan-2-one, N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide, N-[3-(2-oxopropyl)-1,3-benzothiazol-2-ylidene]acetamide, N-((2Z)-3-(2-Oxopropyl)-1,3-benzothiazol-2(3H)-ylidene)acetamide #
| Molecular Formula | C12H12N2O2S |
|---|---|
| Molecular Weight | 248.06 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 75.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.06195 |
| Heavy Atoms | 17 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 67073-25-0 |
|---|---|
| SMILES | CC(=O)CN1C2=CC=CC=C2SC1=NC(=O)C |
| InChIKey | UFVKAVRVOQMTNK-UHFFFAOYSA-N |
Product Overview
N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide (CAS 67073-25-0), with molecular formula C12H12N2O2S and molecular weight 248.06 g/mol. IUPAC: N-[3-(2-oxopropyl)-1,3-benzothiazol-2-ylidene]acetamide.
Chemical Property Profile of N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide
Property Insights of N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide. The TPSA of 75.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide. Following Lipinski's Rule of Five, N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide has 0 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-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide?
The CAS number of N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide is 67073-25-0.
What is the molecular formula of N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide?
The molecular formula of N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide is C12H12N2O2S.
What is the molecular weight of N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide?
The molecular weight of N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide is 248.06 g/mol.
Where can I buy N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide?
You can request a quote for N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(2-Oxopropyl)-2(3H)-benzothiazolylidene]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.