![4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol structure](/static/products/847/847038-73-7.png)
4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol
TL;DR: 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol (CAS 847038-73-7) is a chemical compound with molecular formula C20H19BrN2OS and molecular weight 414.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione
Also Known As: 4-(3-bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol, 4-(3-bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione, 4-(3-bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2(1H)-thione
| Molecular Formula | C20H19BrN2OS |
|---|---|
| Molecular Weight | 414.04 g/mol |
| LogP | 4.7241 |
| Topological Polar Surface Area | 33.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 414.04016 |
| Heavy Atoms | 25 |
| Complexity | 877.74994 |
Chemical Identifiers
| CAS Number | 847038-73-7 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C2C3=C(C4=CC=CC=C4CC3)NC(=S)N2)Br |
Product Overview
4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol (CAS 847038-73-7), with molecular formula C20H19BrN2OS and molecular weight 414.04 g/mol. IUPAC: 4-(3-bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione.
Chemical Property Profile of 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol
Property Insights of 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol
The XLogP value of 4.7241 indicates that 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.29 Ų, 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol has 2 hydrogen bond donor(s) and 2 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 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol?
The CAS number of 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol is 847038-73-7.
What is the molecular formula of 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol?
The molecular formula of 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol is C20H19BrN2OS.
What is the molecular weight of 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol?
The molecular weight of 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol is 414.04 g/mol.
Where can I buy 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol?
You can request a quote for 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Bromo-4-ethoxyphenyl)-3,4,5,6-tetrahydrobenzo[h]quinazoline-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.