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4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione
TL;DR: 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione (CAS 688355-99-9) is a chemical compound with molecular formula C16H15N3OS and molecular weight 297.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione
Also Known As: 4-((3-methoxybenzyl)amino)quinazoline-2(1H)-thione, 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione, F6548-4686, 4-{[(3-methoxyphenyl)methyl]amino}-1,2-dihydroquinazoline-2-thione
| Molecular Formula | C16H15N3OS |
|---|---|
| Molecular Weight | 297.09 g/mol |
| LogP | 3.91309 |
| Topological Polar Surface Area | 49.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 297.0936 |
| Heavy Atoms | 21 |
| Complexity | 828.86505 |
Chemical Identifiers
| CAS Number | 688355-99-9 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CNC2=NC(=S)NC3=CC=CC=C32 |
Product Overview
4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione (CAS 688355-99-9), with molecular formula C16H15N3OS and molecular weight 297.09 g/mol. IUPAC: 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione.
Chemical Property Profile of 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione
Property Insights of 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione
The XLogP value of 3.91309 indicates that 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.94 Ų, 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione has 2 hydrogen bond donor(s) and 4 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-methoxyphenyl)methylamino]-1H-quinazoline-2-thione?
The CAS number of 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione is 688355-99-9.
What is the molecular formula of 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione?
The molecular formula of 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione is C16H15N3OS.
What is the molecular weight of 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione?
The molecular weight of 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione is 297.09 g/mol.
Where can I buy 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione?
You can request a quote for 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3-methoxyphenyl)methylamino]-1H-quinazoline-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.