![4-methyl-n-[thiocarbamoyl]-2- pentanamide structure](/static/products/7204/72045-79-5.webp)
4-methyl-n-[thiocarbamoyl]-2- pentanamide
TL;DR: 4-methyl-n-[thiocarbamoyl]-2- pentanamide (CAS 72045-79-5) is a chemical compound with molecular formula C28H28N4O2S and molecular weight 484.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[(4-methylphenyl)carbamothioyl]-2-(4-oxo-2-phenylquinazolin-3-yl)pentanamide
Also Known As: 4-methyl-n-[thiocarbamoyl]-2- pentanamide, 4-methyl-N-[ thiocarbamoyl]-2- pentanamide, 1-(4-Methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-(p-tolyl)-2-thiourea, 4-Methyl-2-(4-oxo-2-phenylquinazolin-3(4H)-yl)-N-(p-tolylcarbamothioyl)pentanamide, Urea, 1-(4-methyl-2-(4-oxo-2-phenyl-3,4-dihydro-3-quinazolinyl)valeryl)-3-(p-tolyl)-2-thio-
| Molecular Formula | C28H28N4O2S |
|---|---|
| Molecular Weight | 484.19 g/mol |
| LogP | 5.47232 |
| Topological Polar Surface Area | 76.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 484.1933 |
| Heavy Atoms | 35 |
| Complexity | 1412.8542 |
Chemical Identifiers
| CAS Number | 72045-79-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=S)NC(=O)C(CC(C)C)N2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4 |
Product Overview
4-methyl-n-[thiocarbamoyl]-2- pentanamide (CAS 72045-79-5), with molecular formula C28H28N4O2S and molecular weight 484.19 g/mol. IUPAC: 4-methyl-N-[(4-methylphenyl)carbamothioyl]-2-(4-oxo-2-phenylquinazolin-3-yl)pentanamide.
Chemical Property Profile of 4-methyl-n-[thiocarbamoyl]-2- pentanamide
Property Insights of 4-methyl-n-[thiocarbamoyl]-2- pentanamide
The XLogP value of 5.47232 indicates that 4-methyl-n-[thiocarbamoyl]-2- pentanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-n-[thiocarbamoyl]-2- pentanamide. Following Lipinski's Rule of Five, 4-methyl-n-[thiocarbamoyl]-2- pentanamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-methyl-n-[thiocarbamoyl]-2- pentanamide?
The CAS number of 4-methyl-n-[thiocarbamoyl]-2- pentanamide is 72045-79-5.
What is the molecular formula of 4-methyl-n-[thiocarbamoyl]-2- pentanamide?
The molecular formula of 4-methyl-n-[thiocarbamoyl]-2- pentanamide is C28H28N4O2S.
What is the molecular weight of 4-methyl-n-[thiocarbamoyl]-2- pentanamide?
The molecular weight of 4-methyl-n-[thiocarbamoyl]-2- pentanamide is 484.19 g/mol.
Where can I buy 4-methyl-n-[thiocarbamoyl]-2- pentanamide?
You can request a quote for 4-methyl-n-[thiocarbamoyl]-2- pentanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-n-[thiocarbamoyl]-2- pentanamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-n-[thiocarbamoyl]-2- pentanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.