![4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide structure](/static/products/1388/1388003-12-0.webp)
4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide
TL;DR: 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide (CAS 1388003-12-0) is a chemical compound with molecular formula C22H16N2O5S2 and molecular weight 452.05005 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide
Also Known As: 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide, (Z)-4-methyl-N-(4-nitrophenyl)-N-((3-oxobenzo[b]thiophen-2(3H)-ylidene)methyl)benzenesulfonamide, 4-methyl-N-(4-nitrophenyl)-N-[(3-oxo-1-benzothien-2(3H)-ylidene)methyl]benzenesulfonamide, 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]benzenesulfonamide, 4-METHYL-N-(4-NITROPHENYL)-N-{[(2Z)-3-OXO-2,3-DIHYDRO-1-BENZOTHIOPHEN-2-YLIDENE]METHYL}BENZENE-1-SULFONAMIDE
Technical Specifications
| Molecular Formula | C22H16N2O5S2 |
| Molecular Weight | 452.05005 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 134.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 452.05005 Da |
| Heavy Atoms | 31 |
| Complexity | 816.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(/C=C\2/C(=O)C3=CC=CC=C3S2)C4=CC=C(C=C4)[N+](=O)[O-] |
| InChIKey | OOJXVUNFEDCKLG-STZFKDTASA-N |
Chemical Property Profile of 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide
Property Insights of 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide
The XLogP value of 4.8 indicates that 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide. Following Lipinski's Rule of Five, 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide?
The CAS number of 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide is 1388003-12-0.
What is the molecular formula of 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide?
The molecular formula of 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide is C22H16N2O5S2.
What is the molecular weight of 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide?
The molecular weight of 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide is 452.05005 g/mol.
Where can I buy 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide?
You can request a quote for 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide?
Yes, CoreyChem provides custom synthesis services for 4-methyl-N-(4-nitrophenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.