![N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea structure](/static/products/791/791791-69-0.png)
N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea
TL;DR: N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea (CAS 791791-69-0) is a chemical compound with molecular formula C11H14N2OS2 and molecular weight 254.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(propan-2-ylcarbamothioyl)-3-thiophen-2-ylprop-2-enamide
Also Known As: N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea, AN-329/42581133, N-Isopropyl-N/'-[3-(2-thienyl)acryloyl]thiourea, (E)-N-(propan-2-ylcarbamothioyl)-3-thiophen-2-ylprop-2-enamide, N-[(isopropylamino)carbonothioyl]-3-(2-thienyl)acrylamide
| Molecular Formula | C11H14N2OS2 |
|---|---|
| Molecular Weight | 254.05 g/mol |
| LogP | 2.1604 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.05475 |
| Heavy Atoms | 16 |
| Complexity | 382.69864 |
Chemical Identifiers
| CAS Number | 791791-69-0 |
|---|---|
| SMILES | CC(C)NC(=S)NC(=O)/C=C/C1=CC=CS1 |
Product Overview
N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea (CAS 791791-69-0), with molecular formula C11H14N2OS2 and molecular weight 254.05 g/mol. IUPAC: (E)-N-(propan-2-ylcarbamothioyl)-3-thiophen-2-ylprop-2-enamide.
Chemical Property Profile of N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea
Property Insights of N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea
The XLogP value of 2.1604 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea. With a topological polar surface area (TPSA) of 41.13 Ų, N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea has 2 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-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea?
The CAS number of N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea is 791791-69-0.
What is the molecular formula of N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea?
The molecular formula of N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea is C11H14N2OS2.
What is the molecular weight of N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea?
The molecular weight of N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea is 254.05 g/mol.
Where can I buy N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea?
You can request a quote for N-isopropyl-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-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-isopropyl-N'-[3-(2-thienyl)acryloyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.