N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide
TL;DR: N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide (CAS 443353-11-5) is a chemical compound with molecular formula C19H19N3O2S and molecular weight 353.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)butanamide
Also Known As: N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide, N-benzyl-4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)butanamide, F0913-3652, N-benzyl-4-(4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl)butanamide
| Molecular Formula | C19H19N3O2S |
|---|---|
| Molecular Weight | 353.12 g/mol |
| LogP | 3.15569 |
| Topological Polar Surface Area | 66.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.1198 |
| Heavy Atoms | 25 |
| Complexity | 992.717 |
Chemical Identifiers
| CAS Number | 443353-11-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)CCCN2C(=O)C3=CC=CC=C3NC2=S |
Product Overview
N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide (CAS 443353-11-5), with molecular formula C19H19N3O2S and molecular weight 353.12 g/mol. IUPAC: N-benzyl-4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)butanamide.
Chemical Property Profile of N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide
Property Insights of N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide
The XLogP value of 3.15569 indicates that N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.89 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide. Following Lipinski's Rule of Five, N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide has 2 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 N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide?
The CAS number of N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide is 443353-11-5.
What is the molecular formula of N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide?
The molecular formula of N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide is C19H19N3O2S.
What is the molecular weight of N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide?
The molecular weight of N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide is 353.12 g/mol.
Where can I buy N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide?
You can request a quote for N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-4-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.