3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one
TL;DR: 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one (CAS 775300-73-7) is a chemical compound with molecular formula C17H16N2OS and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-phenylpropyl)-2-sulfanylidene-1H-quinazolin-4-one
Also Known As: 3-(3-phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one, 2-mercapto-3-(3-phenylpropyl)quinazolin-4(3H)-one, 3-(3-phenylpropyl)-2-sulfanylidene-1H-quinazolin-4-one, 4-hydroxy-3-(3-phenylpropyl)quinazoline-2-thione, 3-(3-phenylpropyl)-2-sulfanyl-4(3H)-quinazolinone
| Molecular Formula | C17H16N2OS |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 3.69189 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.09833 |
| Heavy Atoms | 21 |
| Complexity | 865.08765 |
Chemical Identifiers
| CAS Number | 775300-73-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCCN2C(=O)C3=CC=CC=C3NC2=S |
Product Overview
3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one (CAS 775300-73-7), with molecular formula C17H16N2OS and molecular weight 296.10 g/mol. IUPAC: 3-(3-phenylpropyl)-2-sulfanylidene-1H-quinazolin-4-one.
Chemical Property Profile of 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one
Property Insights of 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one
The XLogP value of 3.69189 indicates that 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-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, 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one has 1 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 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one?
The CAS number of 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one is 775300-73-7.
What is the molecular formula of 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one?
The molecular formula of 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one is C17H16N2OS.
What is the molecular weight of 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one?
The molecular weight of 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one is 296.10 g/mol.
Where can I buy 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one?
You can request a quote for 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Phenylpropyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.