![3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone structure](/static/products/1074/107428-08-0.webp)
3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone
TL;DR: 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone (CAS 107428-08-0) is a chemical compound with molecular formula C17H17N3O and molecular weight 279.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-2-nona-2,7-diyn-5-ylquinazolin-4-one
Also Known As: 3-amino-2-nona-2,7-diyn-5-ylquinazolin-4-one, 3-amino-2-[1-(2-butynyl)-3-pentynyl]-4(3H)-quinazolinone, AD-310/37069067, 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone, 3-Amino-2-(nona-2,7-diyn-5-yl)quinazolin-4(3H)-one
| Molecular Formula | C17H17N3O |
|---|---|
| Molecular Weight | 279.14 g/mol |
| LogP | 2.0207 |
| Topological Polar Surface Area | 60.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.13718 |
| Heavy Atoms | 21 |
| Complexity | 806.195 |
Chemical Identifiers
| CAS Number | 107428-08-0 |
|---|---|
| SMILES | CC#CCC(CC#CC)C1=NC2=CC=CC=C2C(=O)N1N |
Product Overview
3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone (CAS 107428-08-0), with molecular formula C17H17N3O and molecular weight 279.14 g/mol. IUPAC: 3-amino-2-nona-2,7-diyn-5-ylquinazolin-4-one.
Chemical Property Profile of 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone
Property Insights of 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone
The XLogP value of 2.0207 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone. The TPSA of 60.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone. Following Lipinski's Rule of Five, 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone 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 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone?
The CAS number of 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone is 107428-08-0.
What is the molecular formula of 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone?
The molecular formula of 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone is C17H17N3O.
What is the molecular weight of 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone?
The molecular weight of 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone is 279.14 g/mol.
Where can I buy 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone?
You can request a quote for 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-2-[1-(2-butyn-1-yl)-4-methyl-3-butyn-1-yl]-4(3H)-quinazolinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.