2-(Propanoylcarbamothioylamino)benzamide
TL;DR: 2-(Propanoylcarbamothioylamino)benzamide (CAS 535964-58-0) is a chemical compound with molecular formula C11H13N3O2S and molecular weight 251.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(propanoylcarbamothioylamino)benzamide
Also Known As: 2-(propanoylcarbamothioylamino)benzamide, 2-[(propanoylcarbamothioyl)amino]benzamide, 2-{[(propionylamino)carbothioyl]amino}benzamide, AN-989/41518333
| Molecular Formula | C11H13N3O2S |
|---|---|
| Molecular Weight | 251.07 g/mol |
| LogP | 1.0085 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 251.07285 |
| Heavy Atoms | 17 |
| Complexity | 459.7847 |
Chemical Identifiers
| CAS Number | 535964-58-0 |
|---|---|
| SMILES | CCC(=O)NC(=S)NC1=CC=CC=C1C(=O)N |
Product Overview
2-(Propanoylcarbamothioylamino)benzamide (CAS 535964-58-0), with molecular formula C11H13N3O2S and molecular weight 251.07 g/mol. IUPAC: 2-(propanoylcarbamothioylamino)benzamide.
Chemical Property Profile of 2-(Propanoylcarbamothioylamino)benzamide
Property Insights of 2-(Propanoylcarbamothioylamino)benzamide
The XLogP value of 1.0085 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Propanoylcarbamothioylamino)benzamide. The TPSA of 84.22 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Propanoylcarbamothioylamino)benzamide. Following Lipinski's Rule of Five, 2-(Propanoylcarbamothioylamino)benzamide has 3 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 2-(Propanoylcarbamothioylamino)benzamide?
The CAS number of 2-(Propanoylcarbamothioylamino)benzamide is 535964-58-0.
What is the molecular formula of 2-(Propanoylcarbamothioylamino)benzamide?
The molecular formula of 2-(Propanoylcarbamothioylamino)benzamide is C11H13N3O2S.
What is the molecular weight of 2-(Propanoylcarbamothioylamino)benzamide?
The molecular weight of 2-(Propanoylcarbamothioylamino)benzamide is 251.07 g/mol.
Where can I buy 2-(Propanoylcarbamothioylamino)benzamide?
You can request a quote for 2-(Propanoylcarbamothioylamino)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Propanoylcarbamothioylamino)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(Propanoylcarbamothioylamino)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.