4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one
TL;DR: 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one (CAS 898450-65-2) is a chemical compound with molecular formula C19H18N2OS and molecular weight 322.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(naphthalen-1-ylmethylsulfanyl)-5,6,7,8-tetrahydro-1H-quinazolin-2-one
Also Known As: F2684-0117, 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one, 4-(naphthalen-1-ylmethylsulfanyl)-5,6,7,8-tetrahydro-1H-quinazolin-2-one, 4-[(1-naphthyl)methylthio]-5,6,7,8-tetrahydro-2(1H)-quinazolinone
| Molecular Formula | C19H18N2OS |
|---|---|
| Molecular Weight | 322.11 g/mol |
| LogP | 4.0942 |
| Topological Polar Surface Area | 45.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.11398 |
| Heavy Atoms | 23 |
| Complexity | 911.38184 |
Chemical Identifiers
| CAS Number | 898450-65-2 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=NC(=O)N2)SCC3=CC=CC4=CC=CC=C43 |
Product Overview
4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one (CAS 898450-65-2), with molecular formula C19H18N2OS and molecular weight 322.11 g/mol. IUPAC: 4-(naphthalen-1-ylmethylsulfanyl)-5,6,7,8-tetrahydro-1H-quinazolin-2-one.
Chemical Property Profile of 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one
Property Insights of 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one
The XLogP value of 4.0942 indicates that 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.75 Ų, 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one 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 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one?
The CAS number of 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one is 898450-65-2.
What is the molecular formula of 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one?
The molecular formula of 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one is C19H18N2OS.
What is the molecular weight of 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one?
The molecular weight of 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one is 322.11 g/mol.
Where can I buy 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one?
You can request a quote for 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-((naphthalen-1-ylmethyl)thio)-5,6,7,8-tetrahydroquinazolin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.