N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide
TL;DR: N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide (CAS 380477-54-3) is a chemical compound with molecular formula C22H15Cl2N3O2S and molecular weight 455.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide
Also Known As: CBKinase1_001685, CBKinase1_014085, N-(3-chlorophenyl)-2-{[3-(4-chlorophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetamide, N-(3-chlorophenyl)-2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide, BRD-K31156677-001-01-8
| Molecular Formula | C22H15Cl2N3O2S |
|---|---|
| Molecular Weight | 455.03 g/mol |
| LogP | 5.4233 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 455.0262 |
| Heavy Atoms | 30 |
| Complexity | 1289.8035 |
Chemical Identifiers
| CAS Number | 380477-54-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=CC(=CC=C3)Cl)C4=CC=C(C=C4)Cl |
Product Overview
N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide (CAS 380477-54-3), with molecular formula C22H15Cl2N3O2S and molecular weight 455.03 g/mol. IUPAC: N-(3-chlorophenyl)-2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide.
Chemical Property Profile of N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide
Property Insights of N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide
The XLogP value of 5.4233 indicates that N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide. Following Lipinski's Rule of Five, N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide has 1 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 N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide?
The CAS number of N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide is 380477-54-3.
What is the molecular formula of N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide?
The molecular formula of N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide is C22H15Cl2N3O2S.
What is the molecular weight of N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide?
The molecular weight of N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide is 455.03 g/mol.
Where can I buy N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide?
You can request a quote for N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-CL-PH)-2-((3-(4-CL-Phenyl)-4-oxo-3,4-dihydro-2-quinazolinyl)thio)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.