ChemDiv2_005188
TL;DR: ChemDiv2_005188 (CAS 442869-69-4) is a chemical compound with molecular formula C24H21N3O2S and molecular weight 415.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanyl-N-methyl-N-phenylacetamide
Also Known As: ChemDiv2_005188, IDI1_003903, 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanyl-N-methyl-N-phenylacetamide, 2-[(3-benzyl-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-methyl-N-phenylacetamide, A2545/0108343
| Molecular Formula | C24H21N3O2S |
|---|---|
| Molecular Weight | 415.14 g/mol |
| LogP | 4.1999 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 415.13544 |
| Heavy Atoms | 30 |
| Complexity | 1223.6451 |
Chemical Identifiers
| CAS Number | 442869-69-4 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4 |
Product Overview
ChemDiv2_005188 (CAS 442869-69-4), with molecular formula C24H21N3O2S and molecular weight 415.14 g/mol. IUPAC: 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanyl-N-methyl-N-phenylacetamide.
Chemical Property Profile of ChemDiv2_005188
Property Insights of ChemDiv2_005188
The XLogP value of 4.1999 indicates that ChemDiv2_005188 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, ChemDiv2_005188 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv2_005188 has 0 hydrogen bond donor(s) and 4 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 ChemDiv2_005188?
The CAS number of ChemDiv2_005188 is 442869-69-4.
What is the molecular formula of ChemDiv2_005188?
The molecular formula of ChemDiv2_005188 is C24H21N3O2S.
What is the molecular weight of ChemDiv2_005188?
The molecular weight of ChemDiv2_005188 is 415.14 g/mol.
Where can I buy ChemDiv2_005188?
You can request a quote for ChemDiv2_005188 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_005188?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_005188 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.