![3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione structure](/static/products/3301/330197-72-3.webp)
3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione
TL;DR: 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione (CAS 330197-72-3) is a chemical compound with molecular formula C16H13ClN2O2S and molecular weight 332.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione
Also Known As: AB00082755-01, AI-204/31721039, 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione, 3-(2-(4-CHLORO-PHENYLSULFANYL)-ETHYL)-1H-QUINAZOLINE-2,4-DIONE, 3-{2-[(4-chlorophenyl)sulfanyl]ethyl}-2,4(1H,3H)-quinazolinedione
| Molecular Formula | C16H13ClN2O2S |
|---|---|
| Molecular Weight | 332.04 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.03864 |
| Heavy Atoms | 22 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 330197-72-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C(=O)N2)CCSC3=CC=C(C=C3)Cl |
| InChIKey | BCCXTTODLDKMFO-UHFFFAOYSA-N |
Product Overview
3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione (CAS 330197-72-3), with molecular formula C16H13ClN2O2S and molecular weight 332.04 g/mol. IUPAC: 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione.
Chemical Property Profile of 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione
Property Insights of 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione
The XLogP value of 3.5 indicates that 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione. Following Lipinski's Rule of Five, 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione has 1 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 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione?
The CAS number of 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione is 330197-72-3.
What is the molecular formula of 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione?
The molecular formula of 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione is C16H13ClN2O2S.
What is the molecular weight of 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione?
The molecular weight of 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione is 332.04 g/mol.
Where can I buy 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione?
You can request a quote for 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(4-chlorophenyl)sulfanylethyl]-1H-quinazoline-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.