Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)-
TL;DR: Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)- (CAS 149488-58-4) is a chemical compound with molecular formula C13H10F2N4S2 and molecular weight 324.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-cyano-1,3-thiazol-2-yl)-3-[2-(2,6-difluorophenyl)ethyl]thiourea
Also Known As: PETT Analog 56, PETT 4-CN thiazol deriv., Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)-, 1-(4-cyanothiazol-2-yl)-3-[2-(2,6-difluorophenyl)ethyl]thiourea, 1-(4-cyano-1,3-thiazol-2-yl)-3-[2-(2,6-difluorophenyl)ethyl]thiourea
| Molecular Formula | C13H10F2N4S2 |
|---|---|
| Molecular Weight | 324.03 g/mol |
| LogP | 2.82208 |
| Topological Polar Surface Area | 60.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.0315 |
| Heavy Atoms | 21 |
| Complexity | 673.47 |
Chemical Identifiers
| CAS Number | 149488-58-4 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)F)CCNC(=S)NC2=NC(=CS2)C#N)F |
Product Overview
Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)- (CAS 149488-58-4), with molecular formula C13H10F2N4S2 and molecular weight 324.03 g/mol. IUPAC: 1-(4-cyano-1,3-thiazol-2-yl)-3-[2-(2,6-difluorophenyl)ethyl]thiourea.
Chemical Property Profile of Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)-
Property Insights of Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)-
The XLogP value of 2.82208 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)-. The TPSA of 60.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)-. Following Lipinski's Rule of Five, Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)- has 2 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 Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)-?
The CAS number of Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)- is 149488-58-4.
What is the molecular formula of Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)-?
The molecular formula of Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)- is C13H10F2N4S2.
What is the molecular weight of Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)-?
The molecular weight of Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)- is 324.03 g/mol.
Where can I buy Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)-?
You can request a quote for Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Thiourea, N-(4-cyano-2-thiazolyl)-N'-(2-(2,6-difluorophenyl)ethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.