ChemDiv2_004632
TL;DR: ChemDiv2_004632 (CAS 488123-12-2) is a chemical compound with molecular formula C23H21N3O4S and molecular weight 435.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4,6,7-trimethylquinazolin-2-yl)sulfanylethyl 2-(1,3-dioxoisoindol-2-yl)acetate
Also Known As: ChemDiv2_004632, IDI1_003347, 2-[(4,6,7-trimethylquinazolin-2-yl)sulfanyl]ethyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate, 2-((4,6,7-trimethylquinazolin-2-yl)thio)ethyl 2-(1,3-dioxoisoindolin-2-yl)acetate, 2-(4,6,7-trimethylquinazolin-2-yl)sulfanylethyl 2-(1,3-dioxoisoindol-2-yl)acetate
| Molecular Formula | C23H21N3O4S |
|---|---|
| Molecular Weight | 435.13 g/mol |
| LogP | 3.48656 |
| Topological Polar Surface Area | 89.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 435.12527 |
| Heavy Atoms | 31 |
| Complexity | 1189.9124 |
Chemical Identifiers
| CAS Number | 488123-12-2 |
|---|---|
| SMILES | CC1=CC2=C(N=C(N=C2C=C1C)SCCOC(=O)CN3C(=O)C4=CC=CC=C4C3=O)C |
Product Overview
ChemDiv2_004632 (CAS 488123-12-2), with molecular formula C23H21N3O4S and molecular weight 435.13 g/mol. IUPAC: 2-(4,6,7-trimethylquinazolin-2-yl)sulfanylethyl 2-(1,3-dioxoisoindol-2-yl)acetate.
Chemical Property Profile of ChemDiv2_004632
Property Insights of ChemDiv2_004632
The XLogP value of 3.48656 indicates that ChemDiv2_004632 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.46 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_004632. Following Lipinski's Rule of Five, ChemDiv2_004632 has 0 hydrogen bond donor(s) and 7 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_004632?
The CAS number of ChemDiv2_004632 is 488123-12-2.
What is the molecular formula of ChemDiv2_004632?
The molecular formula of ChemDiv2_004632 is C23H21N3O4S.
What is the molecular weight of ChemDiv2_004632?
The molecular weight of ChemDiv2_004632 is 435.13 g/mol.
Where can I buy ChemDiv2_004632?
You can request a quote for ChemDiv2_004632 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_004632?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_004632 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.