4-(2-ethylhexylamino)-1H-quinazoline-2-thione
TL;DR: 4-(2-ethylhexylamino)-1H-quinazoline-2-thione (CAS 896698-06-9) is a chemical compound with molecular formula C16H23N3S and molecular weight 289.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-ethylhexylamino)-1H-quinazoline-2-thione
Also Known As: ChemDiv3_012768, 4-(2-ethylhexylamino)-1H-quinazoline-2-thione, 4-((2-ethylhexyl)amino)quinazoline-2(1H)-thione, 4-[(2-ethylhexyl)amino]-1,2-dihydroquinazoline-2-thione, BRD-A47532251-001-01-8
| Molecular Formula | C16H23N3S |
|---|---|
| Molecular Weight | 289.16 g/mol |
| LogP | 4.92069 |
| Topological Polar Surface Area | 40.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 289.16125 |
| Heavy Atoms | 20 |
| Complexity | 605.9386 |
Chemical Identifiers
| CAS Number | 896698-06-9 |
|---|---|
| SMILES | CCCCC(CC)CNC1=NC(=S)NC2=CC=CC=C21 |
Product Overview
4-(2-ethylhexylamino)-1H-quinazoline-2-thione (CAS 896698-06-9), with molecular formula C16H23N3S and molecular weight 289.16 g/mol. IUPAC: 4-(2-ethylhexylamino)-1H-quinazoline-2-thione.
Chemical Property Profile of 4-(2-ethylhexylamino)-1H-quinazoline-2-thione
Property Insights of 4-(2-ethylhexylamino)-1H-quinazoline-2-thione
The XLogP value of 4.92069 indicates that 4-(2-ethylhexylamino)-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 40.71 Ų, 4-(2-ethylhexylamino)-1H-quinazoline-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-ethylhexylamino)-1H-quinazoline-2-thione has 2 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-(2-ethylhexylamino)-1H-quinazoline-2-thione?
The CAS number of 4-(2-ethylhexylamino)-1H-quinazoline-2-thione is 896698-06-9.
What is the molecular formula of 4-(2-ethylhexylamino)-1H-quinazoline-2-thione?
The molecular formula of 4-(2-ethylhexylamino)-1H-quinazoline-2-thione is C16H23N3S.
What is the molecular weight of 4-(2-ethylhexylamino)-1H-quinazoline-2-thione?
The molecular weight of 4-(2-ethylhexylamino)-1H-quinazoline-2-thione is 289.16 g/mol.
Where can I buy 4-(2-ethylhexylamino)-1H-quinazoline-2-thione?
You can request a quote for 4-(2-ethylhexylamino)-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-(2-ethylhexylamino)-1H-quinazoline-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-ethylhexylamino)-1H-quinazoline-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.