![N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide structure](/static/products/4497/449771-81-7.webp)
N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide
TL;DR: N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide (CAS 449771-81-7) is a chemical compound with molecular formula C18H19N3O3S and molecular weight 357.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide
Also Known As: N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide, (E)-3-(furan-2-yl)-N-((3-isobutyramidophenyl)carbamothioyl)acrylamide, (2E)-3-(furan-2-yl)-N-({3-[(2-methylpropanoyl)amino]phenyl}carbamothioyl)prop-2-enamide
| Molecular Formula | C18H19N3O3S |
|---|---|
| Molecular Weight | 357.11 g/mol |
| LogP | 3.4005 |
| Topological Polar Surface Area | 83.37 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 357.11472 |
| Heavy Atoms | 25 |
| Complexity | 782.6238 |
Chemical Identifiers
| CAS Number | 449771-81-7 |
|---|---|
| SMILES | CC(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)/C=C/C2=CC=CO2 |
Product Overview
N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide (CAS 449771-81-7), with molecular formula C18H19N3O3S and molecular weight 357.11 g/mol. IUPAC: N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide.
Chemical Property Profile of N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide
Property Insights of N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide
The XLogP value of 3.4005 indicates that N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.37 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide. Following Lipinski's Rule of Five, N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide has 3 hydrogen bond donor(s) and 4 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-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide?
The CAS number of N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide is 449771-81-7.
What is the molecular formula of N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide?
The molecular formula of N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide is C18H19N3O3S.
What is the molecular weight of N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide?
The molecular weight of N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide is 357.11 g/mol.
Where can I buy N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide?
You can request a quote for N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-[[(E)-3-(furan-2-yl)prop-2-enoyl]carbamothioylamino]phenyl]-2-methylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.