N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide
TL;DR: N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide (CAS 450371-65-0) is a chemical compound with molecular formula C18H17N3O2S and molecular weight 339.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide
Also Known As: AB00672896-01, N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide, N-benzyl-3-(4-oxo-2-thioxo-1,2-dihydroquinazolin-3(4H)-yl)propanamide, F0913-4097, N-benzyl-3-(4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-3-yl)propanamide
| Molecular Formula | C18H17N3O2S |
|---|---|
| Molecular Weight | 339.10 g/mol |
| LogP | 2.76559 |
| Topological Polar Surface Area | 66.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.10416 |
| Heavy Atoms | 24 |
| Complexity | 976.7156 |
Chemical Identifiers
| CAS Number | 450371-65-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S |
Product Overview
N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide (CAS 450371-65-0), with molecular formula C18H17N3O2S and molecular weight 339.10 g/mol. IUPAC: N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide.
Chemical Property Profile of N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide
Property Insights of N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide
The XLogP value of 2.76559 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide. The TPSA of 66.89 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide. Following Lipinski's Rule of Five, N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide 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-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide?
The CAS number of N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide is 450371-65-0.
What is the molecular formula of N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide?
The molecular formula of N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide is C18H17N3O2S.
What is the molecular weight of N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide?
The molecular weight of N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide is 339.10 g/mol.
Where can I buy N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide?
You can request a quote for N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.