![N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide structure](/static/products/116/1164484-94-9.webp)
N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide
TL;DR: N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide (CAS 1164484-94-9) is a chemical compound with molecular formula C13H13NO2S and molecular weight 247.0667 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide
Also Known As: N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide, (Z)-N-methyl-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)propionamide, N-Methyl-N-[3-oxo-3H-benzo[b]thiophen-(2Z)-ylidenemethyl]-propionamide, N-[(Z)-(3-ketobenzothiophen-2-ylidene)methyl]-N-methyl-propionamide, N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]propanamide
Technical Specifications
| Molecular Formula | C13H13NO2S |
| Molecular Weight | 247.0667 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 62.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.0667 Da |
| Heavy Atoms | 17 |
| Complexity | 364.0 |
| SMILES | CCC(=O)N(C)/C=C\1/C(=O)C2=CC=CC=C2S1 |
| InChIKey | GRUBXNOZRDXRIR-FLIBITNWSA-N |
Chemical Property Profile of N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide
Property Insights of N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide. Following Lipinski's Rule of Five, N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide 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
What is the CAS number of N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide?
The CAS number of N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide is 1164484-94-9.
What is the molecular formula of N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide?
The molecular formula of N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide is C13H13NO2S.
What is the molecular weight of N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide?
The molecular weight of N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide is 247.0667 g/mol.
Where can I buy N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide?
You can request a quote for N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide?
Yes, CoreyChem provides custom synthesis services for N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.