![1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea structure](/static/products/7012/701276-48-4.webp)
1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea
TL;DR: 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea (CAS 701276-48-4) is a chemical compound with molecular formula C11H13ClFN3O2S and molecular weight 305.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea
Also Known As: 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea, N-(3-chloro-4-fluorophenyl)-2-(2-hydroxy-2-methylpropanoyl)hydrazinecarbothioamide, N-({[(3-chloro-4-fluorophenyl)amino]thioxomethyl}amino)-2-hydroxy-2-methylprop anamide
| Molecular Formula | C11H13ClFN3O2S |
|---|---|
| Molecular Weight | 305.04 g/mol |
| LogP | 1.5676 |
| Topological Polar Surface Area | 73.39 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 305.0401 |
| Heavy Atoms | 19 |
| Complexity | 505.20392 |
Chemical Identifiers
| CAS Number | 701276-48-4 |
|---|---|
| SMILES | CC(C)(C(=O)NNC(=S)NC1=CC(=C(C=C1)F)Cl)O |
Product Overview
1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea (CAS 701276-48-4), with molecular formula C11H13ClFN3O2S and molecular weight 305.04 g/mol. IUPAC: 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea.
Chemical Property Profile of 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea
Property Insights of 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea
The XLogP value of 1.5676 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea. The TPSA of 73.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea. Following Lipinski's Rule of Five, 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea has 4 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 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea?
The CAS number of 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea is 701276-48-4.
What is the molecular formula of 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea?
The molecular formula of 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea is C11H13ClFN3O2S.
What is the molecular weight of 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea?
The molecular weight of 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea is 305.04 g/mol.
Where can I buy 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea?
You can request a quote for 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-chloro-4-fluorophenyl)-3-[(2-hydroxy-2-methylpropanoyl)amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.