2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide
TL;DR: 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide (CAS 799784-36-4) is a chemical compound with molecular formula C21H22IN3O2S and molecular weight 507.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide
Also Known As: 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide, 2-(3-benzyl-6-iodo-4-oxo-quinazolin-2-yl)sulfanyl-N,N-diethyl-acetamide, 2-((3-benzyl-6-iodo-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N,N-diethylacetamide, 2-[(3-benzyl-6-iodo-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N,N-diethylacetamide
| Molecular Formula | C21H22IN3O2S |
|---|---|
| Molecular Weight | 507.05 g/mol |
| LogP | 4.0099 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 507.04776 |
| Heavy Atoms | 28 |
| Complexity | 1032.9952 |
Chemical Identifiers
| CAS Number | 799784-36-4 |
|---|---|
| SMILES | CCN(CC)C(=O)CSC1=NC2=C(C=C(C=C2)I)C(=O)N1CC3=CC=CC=C3 |
Product Overview
2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide (CAS 799784-36-4), with molecular formula C21H22IN3O2S and molecular weight 507.05 g/mol. IUPAC: 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide.
Chemical Property Profile of 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide
Property Insights of 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide
The XLogP value of 4.0099 indicates that 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide has 0 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 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide?
The CAS number of 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide is 799784-36-4.
What is the molecular formula of 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide?
The molecular formula of 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide is C21H22IN3O2S.
What is the molecular weight of 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide?
The molecular weight of 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide is 507.05 g/mol.
Where can I buy 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide?
You can request a quote for 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-diethylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.