![N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide structure](/static/products/6429/642975-68-6.webp)
N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide
TL;DR: N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide (CAS 642975-68-6) is a chemical compound with molecular formula C17H17N3OS and molecular weight 311.10922 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide
Also Known As: N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide, N-(4-anilinophenyl)-N'-(cyclopropylcarbonyl)thiourea, AN-329/41574766, N-{[(4-anilinophenyl)amino]carbonothioyl}cyclopropanecarboxamide, N-{[4-(phenylamino)phenyl]carbamothioyl}cyclopropanecarboxamide
Technical Specifications
| Molecular Formula | C17H17N3OS |
| Molecular Weight | 311.10922 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 85.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.10922 Da |
| Heavy Atoms | 22 |
| Complexity | 397.0 |
| SMILES | C1CC1C(=O)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3 |
| InChIKey | IKXGMBRMZAMOJJ-UHFFFAOYSA-N |
Chemical Property Profile of N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide
Property Insights of N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide
The XLogP value of 3.9 indicates that N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide. Following Lipinski's Rule of Five, N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide has 3 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-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide?
The CAS number of N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide is 642975-68-6.
What is the molecular formula of N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide?
The molecular formula of N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide is C17H17N3OS.
What is the molecular weight of N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide?
The molecular weight of N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide is 311.10922 g/mol.
Where can I buy N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide?
You can request a quote for N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide?
Yes, CoreyChem provides custom synthesis services for N-[(4-anilinophenyl)carbamothioyl]cyclopropanecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.