Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)-
TL;DR: Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)- (CAS 74779-60-5) is a chemical compound with molecular formula C11H12N2O3S and molecular weight 252.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-[benzoyl(carbamoyl)amino] propanethioate
Also Known As: N- -N- benzamide, N-Benzoyl-N-(propanethioyloxy)urea, N-Benzoyl-N-(propanethioyloxy)urea #, O-[benzoyl(carbamoyl)amino] propanethioate, N-carbamoyl-1-phenylformamido propanethioate
| Molecular Formula | C11H12N2O3S |
|---|---|
| Molecular Weight | 252.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.05687 |
| Heavy Atoms | 17 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 74779-60-5 |
|---|---|
| SMILES | CCC(=S)ON(C(=O)C1=CC=CC=C1)C(=O)N |
| InChIKey | IWAGPMYGSWBULI-UHFFFAOYSA-N |
Product Overview
Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)- (CAS 74779-60-5), with molecular formula C11H12N2O3S and molecular weight 252.06 g/mol. IUPAC: O-[benzoyl(carbamoyl)amino] propanethioate.
Chemical Property Profile of Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)-
Property Insights of Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)-. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)-. Following Lipinski's Rule of Five, Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)- has 1 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 Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)-?
The CAS number of Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)- is 74779-60-5.
What is the molecular formula of Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)-?
The molecular formula of Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)- is C11H12N2O3S.
What is the molecular weight of Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)-?
The molecular weight of Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)- is 252.06 g/mol.
Where can I buy Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)-?
You can request a quote for Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Benzamide, N-(aminocarbonyl)-N-(1-thioxopropoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.