N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea
TL;DR: N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea (CAS 791792-50-2) is a chemical compound with molecular formula C14H16N2OS2 and molecular weight 292.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[bis(prop-2-enyl)carbamothioyl]-3-thiophen-2-ylprop-2-enamide
Also Known As: N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea, AN-329/42607877, N,N-Diallyl-N/'-[3-(2-thienyl)acryloyl]thiourea, N-[(diallylamino)carbonothioyl]-3-(2-thienyl)acrylamide, (E)-N-[bis(prop-2-enyl)carbamothioyl]-3-thiophen-2-ylprop-2-enamide
| Molecular Formula | C14H16N2OS2 |
|---|---|
| Molecular Weight | 292.07 g/mol |
| LogP | 2.8364 |
| Topological Polar Surface Area | 32.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 292.0704 |
| Heavy Atoms | 19 |
| Complexity | 467.64523 |
Chemical Identifiers
| CAS Number | 791792-50-2 |
|---|---|
| SMILES | C=CCN(CC=C)C(=S)NC(=O)/C=C/C1=CC=CS1 |
Product Overview
N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea (CAS 791792-50-2), with molecular formula C14H16N2OS2 and molecular weight 292.07 g/mol. IUPAC: (E)-N-[bis(prop-2-enyl)carbamothioyl]-3-thiophen-2-ylprop-2-enamide.
Chemical Property Profile of N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea
Property Insights of N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea
The XLogP value of 2.8364 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea. With a topological polar surface area (TPSA) of 32.34 Ų, N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea has 1 hydrogen bond donor(s) and 3 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,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea?
The CAS number of N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea is 791792-50-2.
What is the molecular formula of N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea?
The molecular formula of N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea is C14H16N2OS2.
What is the molecular weight of N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea?
The molecular weight of N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea is 292.07 g/mol.
Where can I buy N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea?
You can request a quote for N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for N,N-diallyl-N'-[3-(2-thienyl)acryloyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.