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N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide
TL;DR: N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide (CAS 712320-35-9) is a chemical compound with molecular formula C14H15FN2OS and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide
Also Known As: N,N-diallyl-N'-(4-fluorobenzoyl)thiourea, N,N-Diallyl-N/'-(4-fluorobenzoyl)thiourea, N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide, N-[(diallylamino)carbonothioyl]-4-fluorobenzamide, AN-329/42607878
| Molecular Formula | C14H15FN2OS |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 2.5144 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 278.0889 |
| Heavy Atoms | 19 |
| Complexity | 474.72427 |
Chemical Identifiers
| CAS Number | 712320-35-9 |
|---|---|
| SMILES | C=CCN(CC=C)C(=S)NC(=O)C1=CC=C(C=C1)F |
Product Overview
N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide (CAS 712320-35-9), with molecular formula C14H15FN2OS and molecular weight 278.09 g/mol. IUPAC: N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide.
Chemical Property Profile of N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide
Property Insights of N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide
The XLogP value of 2.5144 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide. With a topological polar surface area (TPSA) of 32.34 Ų, N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide has 1 hydrogen bond donor(s) and 2 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-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide?
The CAS number of N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide is 712320-35-9.
What is the molecular formula of N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide?
The molecular formula of N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide is C14H15FN2OS.
What is the molecular weight of N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide?
The molecular weight of N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide is 278.09 g/mol.
Where can I buy N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide?
You can request a quote for N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[bis(prop-2-enyl)carbamothioyl]-4-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.