![5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one structure](/static/products/672/672273-61-9.png)
5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
TL;DR: 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one (CAS 672273-61-9) is a chemical compound with molecular formula C23H24N2OS and molecular weight 376.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-5-methyl-3-(2-phenylethyl)-2-sulfanylidene-1,6-dihydrobenzo[h]quinazolin-4-one
Also Known As: 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one, 3-phenethyl-5-methyl-5-ethyl-4-oxo-2-thioxo-1,2,3,4,5,6-hexahydrobenzo[h]quinazoline, 5-ethyl-5-methyl-3-phenethyl-2-sulfanylidene-1,6-dihydrobenzo[h]quinazolin-4-one, 5-ethyl-5-methyl-3-(2-phenylethyl)-2-thioxo-2,3,5,6-tetrahydrobenzo[h]quinazolin-4(1H)-one
| Molecular Formula | C23H24N2OS |
|---|---|
| Molecular Weight | 376.16 g/mol |
| LogP | 5.03939 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 376.16095 |
| Heavy Atoms | 27 |
| Complexity | 1097.3514 |
Chemical Identifiers
| CAS Number | 672273-61-9 |
|---|---|
| SMILES | CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=S)N3)CCC4=CC=CC=C4)C |
Product Overview
5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one (CAS 672273-61-9), with molecular formula C23H24N2OS and molecular weight 376.16 g/mol. IUPAC: 5-ethyl-5-methyl-3-(2-phenylethyl)-2-sulfanylidene-1,6-dihydrobenzo[h]quinazolin-4-one.
Chemical Property Profile of 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Property Insights of 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
The XLogP value of 5.03939 indicates that 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.79 Ų, 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one has 1 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 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one?
The CAS number of 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one is 672273-61-9.
What is the molecular formula of 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one?
The molecular formula of 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one is C23H24N2OS.
What is the molecular weight of 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one?
The molecular weight of 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one is 376.16 g/mol.
Where can I buy 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one?
You can request a quote for 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-ethyl-2-mercapto-5-methyl-3-phenethyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.