![3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide structure](/static/products/121/1212236-54-8.webp)
3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide
TL;DR: 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide (CAS 1212236-54-8) is a chemical compound with molecular formula C20H21N3O4S and molecular weight 399.12527 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide
Also Known As: 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide, 3,4-Dimethoxy-N-[N'-((1S,2S)-2-phenyl-cyclopropanecarbonyl)-hydrazinocarbothioyl]-benzamide, 3,4-dimethoxy-N-(2-((1S,2S)-2-phenylcyclopropanecarbonyl)hydrazinecarbonothioyl)benzamide, 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]thiocarbamoyl]benzamide, 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropyl]carbonylamino]carbamothioyl]benzamide
Technical Specifications
| Molecular Formula | C20H21N3O4S |
| Molecular Weight | 399.12527 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 121.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.12527 Da |
| Heavy Atoms | 28 |
| Complexity | 582.0 |
| SMILES | COC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)[C@H]2C[C@@H]2C3=CC=CC=C3)OC |
| InChIKey | YFSFTPRYSCYXLC-CABCVRRESA-N |
Chemical Property Profile of 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide
Property Insights of 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide
The XLogP value of 3.3 indicates that 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide. Following Lipinski's Rule of Five, 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide?
The CAS number of 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide is 1212236-54-8.
What is the molecular formula of 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide?
The molecular formula of 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide is C20H21N3O4S.
What is the molecular weight of 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide?
The molecular weight of 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide is 399.12527 g/mol.
Where can I buy 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide?
You can request a quote for 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide?
Yes, CoreyChem provides custom synthesis services for 3,4-dimethoxy-N-[[[(1S,2S)-2-phenylcyclopropanecarbonyl]amino]carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.