1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
TL;DR: 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione (CAS 618396-54-6) is a chemical compound with molecular formula C21H19BrN2S and molecular weight 410.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4-thione
Also Known As: UPCMLD0ENAT5463041:001, 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione, 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4-thione, 1-benzyl-2-(4-bromophenyl)-1,4,5,6,7,8-hexahydroquinazoline-4-thione, 2-(4-bromophenyl)-1-benzyl-1,5,6,7,8-pentahydroquinazoline-4-thione
| Molecular Formula | C21H19BrN2S |
|---|---|
| Molecular Weight | 410.05 g/mol |
| LogP | 5.96919 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 410.04523 |
| Heavy Atoms | 25 |
| Complexity | 946.12524 |
Chemical Identifiers
| CAS Number | 618396-54-6 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=S)N=C(N2CC3=CC=CC=C3)C4=CC=C(C=C4)Br |
Product Overview
1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione (CAS 618396-54-6), with molecular formula C21H19BrN2S and molecular weight 410.05 g/mol. IUPAC: 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4-thione.
Chemical Property Profile of 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
Property Insights of 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
The XLogP value of 5.96919 indicates that 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione?
The CAS number of 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione is 618396-54-6.
What is the molecular formula of 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione?
The molecular formula of 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione is C21H19BrN2S.
What is the molecular weight of 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione?
The molecular weight of 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione is 410.05 g/mol.
Where can I buy 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione?
You can request a quote for 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 1-benzyl-2-(4-bromophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.